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furan-2-ylmethanamine Molecule
InChIKey DDRPCXLAQZKBJP-UHFFFAOYSA-N Molecular Formula C5H7NO
Related Dataset(s)
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hept-1-ene Molecule
InChIKey ZGEGCLOFRBLKSE-UHFFFAOYSA-N Molecular Formula C7H14
Related Dataset(s)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- distortionless enhancement with polarization transfer (DEPT)
- 1-HEPTENE; CI-B; MS
- correlation spectroscopy (COSY)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- distortionless enhancement with polarization transfer (DEPT)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
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hexane-1,6-diol Molecule
InChIKey XXMIOPMDWAUFGU-UHFFFAOYSA-N Molecular Formula C6H14O2
Related Dataset(s)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- distortionless enhancement with polarization transfer (DEPT)
- 1,6-HEXANEDIOL; EI-B; MS
- distortionless enhancement with polarization transfer (DEPT)
- correlation spectroscopy (COSY)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1,6-HEXANEDIOL; EI-B; MS
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methyl 4-aminobenzoate Molecule
InChIKey LZXXNPOYQCLXRS-UHFFFAOYSA-N Molecular Formula C8H9NO2
Related Dataset(s)
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naphthalen-1-yl-(1-pentylindol-3-yl)methanone Molecule
InChIKey JDNLPKCAXICMBW-UHFFFAOYSA-N Molecular Formula C24H23NO
Related Dataset(s)
- JWH-018; LC-ESI-QTOF; MS2; HILIC; CE: 50 eV; R=35000; [M+H]+
- JWH-018; LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+
- infrared absorption spectroscopy (IR)
- JWH-018; LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+Na]+
- JWH-018; LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+Na]+
- JWH-018; LC-ESI-QTOF; MS2; HILIC; CE: 30 eV; R=35000; [M+H]+
- JWH-018; LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+
- JWH-018; LC-ESI-QTOF; MS2; HILIC; CE: 40 eV; R=35000; [M+H]+
- JWH-018; LC-ESI-QTOF; MS2; HILIC; CE: 10 eV; R=35000; [M+H]+
- JWH-018; LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+
- JWH-018; LC-ESI-QTOF; MS2; HILIC; CE: 20 eV; R=35000; [M+H]+
- JWH-018; LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+
- JWH-018; LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+
- JWH-018; LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+Na]+
- JWH-018; LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+Na]+
- JWH-018; LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+Na]+
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pentan-1-amine Molecule
InChIKey DPBLXKKOBLCELK-UHFFFAOYSA-N Molecular Formula C5H13N
Related Dataset(s)
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pentanoic acid Molecule
InChIKey NQPDZGIKBAWPEJ-UHFFFAOYSA-N Molecular Formula C5H10O2
Related Dataset(s)
- Pentanoic acid; LC-ESI-QQ; MS2; CE:30 V; [M-H]-
- Pentanoic acid; LC-ESI-IT; MS2; m/z: 101.2; [M-H]-
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- Pentanoic acid; LC-ESI-QQ; MS2; CE:50 V; [M-H]-
- Propylacetic acid, 1-Butanecarboxylic acid, Valerate, Valerianic acid, Carboxylic Acid C5, n-Valeric acid, Pentanoic acid, Pentanoate, Pentane Acid; LC-ESI-QQ; MS2
- Pentanoic acid; LC-ESI-QQ; MS2; CE:20 V; [M-H]-
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- Propylacetic acid, 1-Butanecarboxylic acid, Valerate, Valerianic acid, Carboxylic Acid C5, n-Valeric acid, Pentanoic acid, Pentanoate, Pentane Acid; LC-ESI-QQ; MS2
- Pentanoic acid; LC-ESI-QQ; MS2; CE:40 V; [M-H]-
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- VALERIC ACID; EI-B; MS
- Pentanoic acid; LC-ESI-QQ; MS2; CE:10 V; [M-H]-
- VALERIC ACID; EI-B; MS
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phenylphosphonic acid Molecule
InChIKey QLZHNIAADXEJJP-UHFFFAOYSA-N Molecular Formula C6H7O3P
Related Dataset(s)
- Phenylphosphonic Acid; LC-ESI-QFT; MS2; CE: 30%; R=15000; [M+H]+
- Phenylphosphonic Acid; LC-ESI-QFT; MS2; CE: 15%; R=15000; [M+H]+
- Phenylphosphonic acid; LC-ESI-QTOF; MS2; 40 V
- distortionless enhancement with polarization transfer (DEPT)
- Phenylphosphonic Acid; LC-ESI-QFT; MS2; CE: 75%; R=15000; [M+H]+
- Phenylphosphonic acid; LC-ESI-QTOF; MS2; 30 V
- Phenylphosphonic acid; LC-ESI-QTOF; MS2; 60 V
- PHENYLPHOSPHONIC ACID; EI-B; MS
- Phenylphosphonic acid; LC-ESI-QTOF; MS2; 20 V
- Phenylphosphonic Acid; LC-ESI-QFT; MS2; CE: 45%; R=15000; [M-H]-
- Phenylphosphonic Acid; LC-ESI-QFT; MS2; CE: 90%; R=15000; [M-H]-
- Phenylphosphonic acid; LC-ESI-QTOF; MS2; 120 V
- Phenylphosphonic acid; LC-ESI-QTOF; MS2; 40 V
- Phenylphosphonic Acid; LC-ESI-QFT; MS2; CE: 90%; R=15000; [M+H]+
- Phenylphosphonic acid; LC-ESI-QTOF; MS2; 10 V
- Phenylphosphonic acid; LC-ESI-QTOF; MS2; 110 V
- Phenylphosphonic Acid; LC-ESI-QFT; MS2; CE: 60%; R=15000; [M+H]+
- Phenylphosphonic Acid; LC-ESI-QFT; MS2; CE: 45%; R=15000; [M+H]+
- Phenylphosphonic Acid; LC-ESI-QFT; MS2; CE: 180%; R=15000; [M-H]-
- Phenylphosphonic acid; LC-ESI-QTOF; MS2; 30 V
- Phenylphosphonic acid; LC-ESI-QTOF; MS2; 130 V
- Phenylphosphonic Acid; LC-ESI-QFT; MS2; CE: 180%; R=15000; [M+H]+
- Phenylphosphonic acid; LC-ESI-QTOF; MS2; 60 V
- Phenylphosphonic Acid; LC-ESI-QFT; MS2; CE: 150%; R=15000; [M+H]+
- Phenylphosphonic Acid; LC-ESI-QFT; MS2; CE: 120%; R=15000; [M+H]+
- Phenylphosphonic acid; LC-ESI-QTOF; MS2; 20 V
- infrared absorption spectroscopy (IR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- Phenylphosphonic Acid; LC-ESI-QFT; MS2; CE: 150%; R=15000; [M-H]-
- Phenylphosphonic acid; ESI-QTOF; MS2; CE: 10; [M-H]-
- Phenylphosphonic acid; LC-ESI-QTOF; MS2; 70 V
- Phenylphosphonic Acid; LC-ESI-QFT; MS2; CE: 120%; R=15000; [M-H]-
- Phenylphosphonic acid; LC-ESI-QTOF; MS2; 10 V
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- Phenylphosphonic Acid; LC-ESI-QFT; MS2; CE: 30%; R=15000; [M-H]-
- Phenylphosphonic acid; ESI-QTOF; MS2; CE: 40; [M-H]-
- 31P nuclear magnetic resonance spectroscopy (31P NMR)
- Phenylphosphonic Acid; LC-ESI-QFT; MS2; CE: 75%; R=15000; [M-H]-
- Phenylphosphonic acid; LC-ESI-QTOF; MS2; 50 V
- Phenylphosphonic acid; LC-ESI-QTOF; MS2; 150 V
- Phenylphosphonic acid; LC-ESI-QTOF; MS2; 140 V
- Phenylphosphonic Acid; LC-ESI-QFT; MS2; CE: 15%; R=15000; [M-H]-
- Phenylphosphonic acid; LC-ESI-QTOF; MS2; 100 V
- Phenylphosphonic acid; LC-ESI-QTOF; MS2; 40 V
- Phenylphosphonic Acid; LC-ESI-QFT; MS2; CE: 60%; R=15000; [M-H]-
- Phenylphosphonic acid; LC-ESI-QTOF; MS2; 40 V
- mass spectrometry (MS)
- Phenylphosphonic acid; LC-ESI-QTOF; MS2; 90 V
- Phenylphosphonic acid; ESI-QTOF; MS2; CE: 20; [M-H]-
- Phenylphosphonic acid; LC-ESI-QTOF; MS2; 80 V
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prop-2-enylbenzene Molecule
InChIKey HJWLCRVIBGQPNF-UHFFFAOYSA-N Molecular Formula C9H10
Related Dataset(s)
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quinoxaline Molecule
InChIKey XSCHRSMBECNVNS-UHFFFAOYSA-N Molecular Formula C8H6N2
Related Dataset(s)
- Quinoxaline; LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
- mass spectrometry (MS)
- QUINOXALINE; EI-B; MS
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- mass spectrometry (MS)
- QUINOXALINE; EI-B; MS
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- infrared absorption spectroscopy (IR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- infrared absorption spectroscopy (IR)
- elemental analysis (EA)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
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tetrabutylazanium;bromide Molecule
InChIKey JRMUNVKIHCOMHV-UHFFFAOYSA-M Molecular Formula C16H36BrN
Related Dataset(s)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- TETRABUTYLAMMONIUM BROMIDE; EI-B; MS
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
-
tetrabutylazanium;iodide Molecule
InChIKey DPKBAXPHAYBPRL-UHFFFAOYSA-M Molecular Formula C16H36IN
Related Dataset(s)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- TETRABUTYLAMMONIUM IODIDE; EI-B; MS
- 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)
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tritert-butylphosphane Molecule
InChIKey BWHDROKFUHTORW-UHFFFAOYSA-N Molecular Formula C12H27P
Related Dataset(s)
- Tri-tert-butylphosphine; LC-ESI-QTOF; MS2; 40 V
- Tri-tert-butylphosphine; LC-ESI-QTOF; MS2; 130 V
- Tri-tert-butylphosphine; LC-ESI-QTOF; MS2; 100 V
- Tri-tert-butylphosphine; LC-ESI-QTOF; MS2; 40 V
- 31P nuclear magnetic resonance spectroscopy (31P NMR)
- Tri-tert-butylphosphine; LC-ESI-QTOF; MS2; 20 V
- Tri-tert-butylphosphine; LC-ESI-QTOF; MS2; 150 V
- Tri-tert-butylphosphine; LC-ESI-QTOF; MS2; 10 V
- Tri-tert-butylphosphine; LC-ESI-QTOF; MS2; 70 V
- Tri-tert-butylphosphine; LC-ESI-QTOF; MS2; 120 V
- Tri-tert-butylphosphine; LC-ESI-QTOF; MS2; 60 V
- Tri-tert-butylphosphine; LC-ESI-QTOF; MS2; 110 V
- Tri-tert-butylphosphine; LC-ESI-QTOF; MS2; 80 V
- Tri-tert-butylphosphine; LC-ESI-QTOF; MS2; 30 V
- Tri-tert-butylphosphine; LC-ESI-QTOF; MS2; 140 V
- Tri-tert-butylphosphine; LC-ESI-QTOF; MS2; 90 V
- Tri-tert-butylphosphine; LC-ESI-QTOF; MS2; 50 V
