-
3-hydroxybenzoic acid Molecule
InChIKey IJFXRHURBJZNAO-UHFFFAOYSA-N Molecular Formula C7H6O3
Related Dataset(s)
- m-Hydroxybenzoic acid; LC-ESI-QQ; MS2; CE:50 V; [M-H]-
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- m-Hydroxybenzoic acid; LC-ESI-QQ; MS2; CE:40 V; [M-H]-
- m-Hydroxybenzoic acid; LC-ESI-QQ; MS2; CE:10 V; [M-H]-
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- META-HYDROXYBENZOIC ACID; EI-B; MS
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- m-Hydroxybenzoic acid; LC-ESI-QQ; MS2; CE:20 V; [M-H]-
- 3-hydroxybenzoic acid; LC-ESI-ITFT; MS2; CE: 50%; R=7500; [M-H]-
- m-Hydroxybenzoic acid; LC-ESI-QQ; MS2; CE:30 V; [M-H]-
- 3-HydroxyBenzoic acid; EI-B; MS; 2 TMS; RT: 619.07 s
-
3-methoxybenzaldehyde Molecule
InChIKey WMPDAIZRQDCGFH-UHFFFAOYSA-N Molecular Formula C8H8O2
Related Dataset(s)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- M-METHOXYBENZALDEHYDE; EI-B; MS
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- META-METHOXYBENZALDEHYDE; EI-B; MS
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
-
4-(2-aminoethyl)phenol Molecule
InChIKey DZGWFCGJZKJUFP-UHFFFAOYSA-N Molecular Formula C8H11NO
Related Dataset(s)
- Tyramine; LC-ESI-ITFT; MS; POS
- Tyramine; LC-ESI-ITFT; MS2; CE 45 eV; [M+H]+
- Hydroxyphenethylamine; LC-ESI-QTOF; MS2; CE:20 eV; [M+H]+
- Tyramine; LC-ESI-QTOF; MS2; CE:30 eV; [M+H]+
- TYRAMINE; LC-ESI-QTOF; MS2; CE: 20eV; R=5000; [M+H]+
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- Tyramine; LC-ESI-ITFT; MS2; m/z:138.09; POS
- Tyramine; LC-ESI-ITFT; MS; [M+H]+; isotope pattern
- Tyramine; LC-ESI-QTOF; MS2; CE:40 eV; [M+H]+
- Tyramine; LC-ESI-ITFT; MS2; m/z:121.06; POS
- Tyramine; GC-EI-TOF; MS; 3 TMS; BP:73
- Hydroxyphenethylamine; LC-ESI-QTOF; MS2; CE:50 eV; [M+H]+
- Tyramine; LC-ESI-QTOF; MS2; CE:20 eV; [M+H]+
- Tyramine; LC-ESI-QTOF; MS2; HILIC; CE: 10 eV; R=35000; [M+H]+
- 2-(4-Hydroxyphenyl)ethylamine, Systogene, 4-(2-Aminoethyl)phenol, Tyramine, 4-Hydroxyphenethylamine, Uteramine, 4-Hydroxy-beta-phenylethylamine, Tyrosamine; LC-ESI-QQ; MS2
- Hydroxyphenethylamine; LC-ESI-QTOF; MS2; CE:30 eV; [M+H]+
- TYRAMINE; LC-ESI-QTOF; MS2; CE: 40eV; R=5000; [M+H]+
- Tyramine; LC-ESI-ITFT; MS2; m/z:308.09; POS
- Tyramine; LC-ESI-ITFT; MS2; CE 70 eV; [M+H]+
- 2-(4-Hydroxyphenyl)ethylamine, Systogene, 4-(2-Aminoethyl)phenol, Tyramine, 4-Hydroxyphenethylamine, Uteramine, 4-Hydroxy-beta-phenylethylamine, Tyrosamine; LC-ESI-QQ; MS2
- Tyramine; LC-ESI-QQ; MS2; CE:30 V; [M+H]+
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- Tyramine; LC-ESI-QQ; MS2; POSITIVE; [M+H-NH3]+; CID; 10 V
- Tyramine; LC-ESI-QQ; MS2; CE:50 V; [M+H]+
- 2-(4-Hydroxyphenyl)ethylamine, 4-(2-aminoethyl)phenol, Systogene, 4-(2-Aminoethyl)phenol, Tyramine, 4-Hydroxyphenethylamine, Uteramine, 4-Hydroxy-beta-phenylethylamine, Tyrosamine; LC-ESI-QTOF; MS2
- Tyramine; LC-ESI-ITFT; MS; POS
- Tyramine; LC-ESI-QQ; MS2; POSITIVE; [M+H]+; CID; 30 V
- Tyramine; LC-ESI-QTOF; MS2; HILIC; CE: 30 eV; R=35000; [M+H]+
- Hydroxyphenethylamine; LC-ESI-QTOF; MS2; CE:40 eV; [M+H]+
- Tyramine; LC-ESI-ITFT; MS2; m/z:150.06; POS
- Tyramine; LC-ESI-QQ; MS2; POSITIVE; [M+H]+; CID; 40 V
- Tyramine; LC-ESI-QQ; MS2; CE:10 V; [M+H]+
- Tyramine; LC-ESI-QQ; MS2; POSITIVE; [M+H-NH3]+; CID; 30 V
- Tyramine; LC-ESI-QQ; MS2; POSITIVE; [M+H-NH3]+; CID; 40 V
- Tyramine; LC-ESI-QQ; MS2; CE:40 V; [M+H]+
- Tyramine; LC-ESI-ITFT; MS2; CE 55 eV; [M+H]+
- Tyramine; EI-B; MS; n TMS; RT: 788.72 s
- Tyramine; LC-ESI-QQ; MS2; POSITIVE; [M+H]+; CID; 20 V
- 2-(4-Hydroxyphenyl)ethylamine, Systogene, 4-(2-Aminoethyl)phenol, Tyramine, 4-Hydroxyphenethylamine, Uteramine, 4-Hydroxy-beta-phenylethylamine, Tyrosamine; LC-ESI-QQ; MS2
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- Tyramine; LC-ESI-QTOF; MS2
- Tyramine; LC-ESI-QTOF; MS2; CE:15 eV; [M+H]+
- Hydroxyphenethylamine; LC-ESI-QTOF; MS2; CE:10 eV; [M+H]+
- Tyramine; LC-ESI-ITFT; MS2; CE 35 eV; [M+H]+
- 2-(4-Hydroxyphenyl)ethylamine, Systogene, 4-(2-Aminoethyl)phenol, Tyramine, 4-Hydroxyphenethylamine, Uteramine, 4-Hydroxy-beta-phenylethylamine, Tyrosamine; LC-ESI-QQ; MS2
- TYRAMINE; LC-ESI-QTOF; MS2; CE: 10eV; R=5000; [M+H]+
- Tyramine; LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- Tyramine; LC-ESI-QQ; MS2; CE:20 V; [M+H]+
- Tyramine; LC-ESI-QQ; MS2; POSITIVE; [M+H]+; CID; 10 V
- 4-(2 AMINOETHYL)-PHENOL; EI-B; MS
- Tyramine; LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
- Tyramine; LC-ESI-ITFT; MS2; m/z:121.06; POS
- Tyramine; LC-ESI-QTOF; MS2; HILIC; CE: 20 eV; R=35000; [M+H]+
- Tyramine; LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
- Tyramine; LC-ESI-QTOF; MS2; CE:15 eV; [M+H]+
- 2-(4-Hydroxyphenyl)ethylamine, Systogene, 4-(2-Aminoethyl)phenol, Tyramine, 4-Hydroxyphenethylamine, Uteramine, 4-Hydroxy-beta-phenylethylamine, Tyrosamine; LC-ESI-QQ; MS2
- Tyramine; LC-ESI-QTOF; MS2; CE:10 eV; [M+H]+
- Tyramine; LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M+H]+
- Tyramine; LC-ESI-QQ; MS2; POSITIVE; [M+H-NH3]+; CID; 20 V
- Tyramine; ESI-QQ; MS; POSITIVE
- 2-(4-Hydroxyphenyl)ethylamine, Systogene, 4-(2-Aminoethyl)phenol, Tyramine, 4-Hydroxyphenethylamine, Uteramine, 4-Hydroxy-beta-phenylethylamine, Tyrosamine; LC-ESI-QQ; MS2
- Tyramine; LC-ESI-ITFT; MS2; m/z:138.09; POS
- Tyramine; LC-ESI-QTOF; MS2; CE:50 eV; [M+H]+
- 1H--1H correlation spectroscopy (1H-1H COSY)
- Tyramine; LC-ESI-QTOF; MS2; CE:20 eV; [M+H]+
- Tyramine; GC-EI-TOF; MS; n TMS; RT:737.844 sec
- Tyramine; GC-EI-TOF; MS; 3 TMS; BP:174
-
4-chlorobenzaldehyde Molecule
InChIKey AVPYQKSLYISFPO-UHFFFAOYSA-N Molecular Formula C7H5ClO
Related Dataset(s)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- P-CHLOROBENZALDEHYDE; EI-B; MS
- distortionless enhancement with polarization transfer (DEPT)
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
-
4-methoxybenzaldehyde Molecule
InChIKey ZRSNZINYAWTAHE-UHFFFAOYSA-N Molecular Formula C8H8O2
Related Dataset(s)
- ANISALDEHYDE; EI-B; MS
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- nuclear magnetic resonance spectroscopy (NMR)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 4-METHOXYBENZALDEHYDE; EI-B; MS
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 4-METHOXYBENZALDEHYDE; EI-B; MS
- PARA-ANISALDEHYDE; EI-B; MS
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- PARA-METHOXYBENZALDEHYDE; EI-B; MS
-
4-methylbenzenesulfonamide Molecule
InChIKey LMYRWZFENFIFIT-UHFFFAOYSA-N Molecular Formula C7H9NO2S
Related Dataset(s)
- p-Toluenesulfonamide; LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
- p-Toluenesulfonamide; LC-ESI-ITFT; MS2; CE: 80; R=15000; [M+H]+
- 4-Toluenesulfonamide; LC-ESI-QFT; MS2; CE: 60; R=35000; [M-H]-
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 4-Toluenesulfonamide; LC-ESI-QFT; MS2; CE: 150; R=35000; [M-H]-
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
- 4-Toluenesulfonamide; LC-ESI-QFT; MS2; CE: 75; R=35000; [M+H]+
- p-Toluenesulfonamide; LC-ESI-ITFT; MS2; CE: 55; R=15000; [M+H]+
- 4-Toluenesulfonamide; LC-ESI-QFT; MS2; CE: 15; R=35000; [M+H]+
- 4-Toluenesulfonamide; LC-ESI-QFT; MS2; CE: 90; R=35000; [M+H]+
- p-Toluenesulfonamide; LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
- 4-Toluenesulfonamide; LC-ESI-QFT; MS2; CE: 45; R=35000; [M+H]+
- PATA-TOLUENESULFONAMIDE; EI-B; MS
- p-Toluenesulfonamide; LC-ESI-ITFT; MS2; CE: 35; R=15000; [M+H]+
- 4-Toluenesulfonamide; LC-ESI-QFT; MS2; CE: 75; R=35000; [M-H]-
- 4-Toluenesulfonamide; LC-ESI-QFT; MS2; CE: 120; R=35000; [M+H]+
- 4-Toluenesulfonamide; LC-ESI-QFT; MS2; CE: 60; R=35000; [M+H]+
- 4-Toluenesulfonamide; LC-ESI-QFT; MS2; CE: 120; R=35000; [M-H]-
- distortionless enhancement with polarization transfer (DEPT)
- 4-Toluenesulfonamide; LC-ESI-QFT; MS2; CE: 30; R=35000; [M-H]-
- correlation spectroscopy (COSY)
- 4-Toluenesulfonamide; LC-ESI-QFT; MS2; CE: 150; R=35000; [M+H]+
- 4-Toluenesulfonamide; LC-ESI-QFT; MS2; CE: 180; R=35000; [M-H]-
- 4-Toluenesulfonamide; LC-ESI-QFT; MS2; CE: 180; R=35000; [M+H]+
- 4-Toluenesulfonamide; LC-ESI-QFT; MS2; CE: 15; R=35000; [M-H]-
- p-Toluenesulfonamide; LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 4-Toluenesulfonamide; LC-ESI-QFT; MS2; CE: 45; R=35000; [M-H]-
- 4-Toluenesulfonamide; LC-ESI-QFT; MS2; CE: 30; R=35000; [M+H]+
- 4-Toluenesulfonamide; LC-ESI-QFT; MS2; CE: 90; R=35000; [M-H]-
- P-TOLUENESULFONAMIDE; EI-B; MS
- p-Toluenesulfonamide; LC-ESI-ITFT; MS2; CE: 55; R=15000; [M+H]+
-
4-propan-2-ylaniline Molecule
InChIKey LRTFPLFDLJYEKT-UHFFFAOYSA-N Molecular Formula C9H13N
Related Dataset(s)
- 4-Isopropylaniline; LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
- 4-Isopropylaniline; LC-ESI-ITFT; MS2; CE: 55; R=15000; [M+H]+
- 4-Isopropylaniline; LC-ESI-ITFT; MS2; CE: 30%; R=7500; [M+H]+
- 4-Isopropylaniline; LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
- 4-Isopropylaniline; LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M+H]+
- 4-Isopropylaniline; LC-ESI-ITFT; MS2; CE: 80; R=15000; [M+H]+
- 4-Isopropylaniline; LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
- 4-Isopropylaniline; LC-ESI-ITFT; MS2; CE: 55; R=15000; [M+H]+
- distortionless enhancement with polarization transfer (DEPT)
- 4-Isopropylaniline; LC-ESI-ITFT; MS2; CE: 15%; R=7500; [M+H]+
- 4-Isopropylaniline; LC-ESI-QTOF; MS2; CE: Ramp 15.7-23.5 eV; R=35000; [M+H]+
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 4-Isopropylaniline; LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M+H]+
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 4-Isopropylaniline; LC-ESI-ITFT; MS2; CE: 35; R=15000; [M+H]+
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 4-Isopropylaniline; LC-ESI-ITFT; MS2; CE: 90%; R=7500; [M+H]+
- 4-Isopropylaniline; LC-ESI-ITFT; MS2; CE: 75%; R=7500; [M+H]+
- distortionless enhancement with polarization transfer (DEPT)
- 4-Isopropylaniline; LC-ESI-ITFT; MS2; CE: 35%; R=7500; [M+H]+
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 4-Isopropylaniline; LC-ESI-ITFT; MS2; CE: 35%; R=30000; [M+H]+
- 4-Isopropylaniline; LC-ESI-ITFT; MS2; CE: 45%; R=7500; [M+H]+
- 4-Isopropylaniline; LC-ESI-ITFT; MS2; CE: 90%; R=30000; [M+H]+
- 4-Isopropylaniline; LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M+H]+
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 4-Isopropylaniline; LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
- 4-Isopropylaniline; LC-ESI-ITFT; MS2; CE: 60%; R=7500; [M+H]+
-
butan-2-one Molecule
InChIKey ZWEHNKRNPOVVGH-UHFFFAOYSA-N Molecular Formula C4H8O
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 2-BUTANONE; EI-B; MS
- ETHYL METHYL KETONE; EI-B; MS
- 2-BUTANONE; EI-B; MS
- correlation spectroscopy (COSY)
- distortionless enhancement with polarization transfer (DEPT)
- ethylmethylketone, methyl ethyl ketone, MeSH, Methylethylketone, Butan-2-one, Oxobutane, Ethyl Methyl Ketone, Methyl acetone, MEK, Meetco, EMK, 2-Butanone; LC-ESI-QQ; MS2
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
-
decane-1,10-diol Molecule
InChIKey FOTKYAAJKYLFFN-UHFFFAOYSA-N Molecular Formula C10H22O2
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1,10-DECANEDIOL; EI-B; MS
- 1,10-DECANEDIOL; EI-B; MS
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
- correlation spectroscopy (COSY)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1,10-DECANEDIOL; EI-B; MS
-
dibenzofuran Molecule
InChIKey TXCDCPKCNAJMEE-UHFFFAOYSA-N Molecular Formula C12H8O
Related Dataset(s)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- DIBENZOFURAN; EI-B; MS
- DIBENZOFURAN; EI-B; MS
- DIBENZOFURAN; EI-B; MS
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
-
diethoxymethoxyethane Molecule
InChIKey GKASDNZWUGIAMG-UHFFFAOYSA-N Molecular Formula C7H16O3
Related Dataset(s)
- TRIETHYL ORTHOFORMATE; CI-B; MS
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- TRIETHYL ORTHOFORMATE; EI-B; MS
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- TRIETHYL ORTHOFORMATE; EI-B; MS
-
diethyl (E)-but-2-enedioate Molecule
InChIKey IEPRKVQEAMIZSS-AATRIKPKSA-N Molecular Formula C8H12O4
Related Dataset(s)
- DIETHYL FUMARATE; EI-B; MS
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- DIETHYL FUMARATE; EI-B; MS
- 1H--1H correlation spectroscopy (1H-1H COSY)
- DIETHYL FUMARATE; EI-B; MS
- FUMARIC ACID DIETHYL ESTER; EI-B; MS
- DIETHYL FUMARATE; EI-B; MS
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
-
dimethoxymethylbenzene Molecule
InChIKey HEVMDQBCAHEHDY-UHFFFAOYSA-N Molecular Formula C9H12O2
Related Dataset(s)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- BENZALDEHYDE DIMETHYL ACETAL; EI-B; MS
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- ALPHA,ALPHA-DIMETHOXYTOLUENE; EI-B; MS
- BENZALDEHYDE DIMETHYL ACETAL; EI-B; MS
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--1H correlation spectroscopy (1H-1H COSY)
-
dimethyl benzene-1,3-dicarboxylate Molecule
InChIKey VNGOYPQMJFJDLV-UHFFFAOYSA-N Molecular Formula C10H10O4
Related Dataset(s)
- DIMETHYL ISOPHTHALATE; EI-B; MS
- DIMETHYL ISOPHTHALATE; EI-B; MS
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- DIMETHYL ISOPHTHALATE; EI-B; MS
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1,3-DIMETHYL PHTHALAE; EI-B; MS
-
dimethyl butanedioate Molecule
InChIKey MUXOBHXGJLMRAB-UHFFFAOYSA-N Molecular Formula C6H10O4
Related Dataset(s)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- BUTANEDIOIC ACID DIMETHYL ESTER; EI-B; MS
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- DIMETHYL SUCCINATE; CI-B; MS
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- DIMETHYL SUCCINATE; EI-B; MS
- DIMETHYL SUCCINATE; EI-B; MS
- DIMETHYL SUCCINATE; EI-B; MS
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- DIMETHYL SUCCINATE; EI-B; MS
-
ethyl 2-methylbenzoate Molecule
InChIKey SOUAXOGPALPTTC-UHFFFAOYSA-N Molecular Formula C10H12O2
Related Dataset(s)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- ETHYL O-TOLUATE; EI-B; MS
- ETHYL ORTHO TOLUATE; EI-B; MS
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
-
ethyl 4-oxopentanoate Molecule
InChIKey GMEONFUTDYJSNV-UHFFFAOYSA-N Molecular Formula C7H12O3
Related Dataset(s)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- ETHYL 4-OXOPENTANOATE; EI-B; MS
- ETHYL LEVULINATE; EI-B; MS
- ETHYL LEVULINATE; EI-B; MS
-
furan-2-carbaldehyde Molecule
InChIKey HYBBIBNJHNGZAN-UHFFFAOYSA-N Molecular Formula C5H4O2
Related Dataset(s)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- distortionless enhancement with polarization transfer (DEPT)
- FURFURAL; CI-B; MS
- distortionless enhancement with polarization transfer (DEPT)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- FURFURAL; EI-B; MS
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- FURFURAL; EI-B; MS
- FURFURAL; EI-B; MS
-
hept-1-ene Molecule
InChIKey ZGEGCLOFRBLKSE-UHFFFAOYSA-N Molecular Formula C7H14
Related Dataset(s)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- distortionless enhancement with polarization transfer (DEPT)
- 1-HEPTENE; CI-B; MS
- correlation spectroscopy (COSY)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
-
hexane-1,6-diol Molecule
InChIKey XXMIOPMDWAUFGU-UHFFFAOYSA-N Molecular Formula C6H14O2
Related Dataset(s)
- correlation spectroscopy (COSY)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- distortionless enhancement with polarization transfer (DEPT)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1,6-HEXANEDIOL; EI-B; MS
- distortionless enhancement with polarization transfer (DEPT)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1,6-HEXANEDIOL; EI-B; MS
