-
1-bromoanthracene-9,10-dione Molecule
InChIKey CXTPIHZYOGDSLV-UHFFFAOYSA-N Molecular Formula C14H7BrO2
Related Dataset(s)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear multiple bond coherence (HMBC)
- heteronuclear single quantum coherence (HSQC)
- correlation spectroscopy (COSY)
-
1-bromonaphthalene Molecule
InChIKey DLKQHBOKULLWDQ-UHFFFAOYSA-N Molecular Formula C10H7Br
Related Dataset(s)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- heteronuclear multiple bond coherence (HMBC)
- distortionless enhancement with polarization transfer (DEPT)
- correlation spectroscopy (COSY)
- heteronuclear single quantum coherence (HSQC)
- 1-BROMONAPHTHALENE; EI-B; MS
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
- 1-BROMONAPHTHALENE; EI-B; MS
-
1-bromopyrrolidine-2,5-dione Molecule
InChIKey PCLIMKBDDGJMGD-UHFFFAOYSA-N Molecular Formula C4H4BrNO2
Related Dataset(s)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- heteronuclear single quantum coherence (HSQC)
- N-BROMOSUCCINIMIDE; EI-B; MS
- heteronuclear multiple bond coherence (HMBC)
- distortionless enhancement with polarization transfer (DEPT)
- distortionless enhancement with polarization transfer (DEPT)
- correlation spectroscopy (COSY)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
-
1-chloro-3,5-dimethylbenzene Molecule
InChIKey FKKLHLZFSZGXBN-UHFFFAOYSA-N Molecular Formula C8H9Cl
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- correlation spectroscopy (COSY)
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear single quantum coherence (HSQC)
- heteronuclear multiple bond coherence (HMBC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
-
1-chloro-4-(methoxymethoxy)-5-methyl-2-propan-2-ylbenzene Molecule
InChIKey LRPMRIMIWRGLKI-UHFFFAOYSA-N Molecular Formula C12H17ClO2
Related Dataset(s)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- heteronuclear single quantum coherence (HSQC)
- mass spectrometry (MS)
- infrared absorption spectroscopy (IR)
- distortionless enhancement with polarization transfer (DEPT)
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear multiple bond coherence (HMBC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
-
1-fluoro-3,5-dimethylbenzene Molecule
InChIKey RCWIWNUVHNAUQC-UHFFFAOYSA-N Molecular Formula C8H9F
Related Dataset(s)
- heteronuclear single quantum coherence (HSQC)
- 19F nuclear magnetic resonance spectroscopy (19F NMR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- heteronuclear multiple bond coherence (HMBC)
- distortionless enhancement with polarization transfer (DEPT)
- correlation spectroscopy (COSY)
- distortionless enhancement with polarization transfer (DEPT)
-
1-hepta-1,6-diynyl-2-phenoxybenzene Molecule
InChIKey KCKMKKGDKVEJAO-UHFFFAOYSA-N Molecular Formula C19H16O
Related Dataset(s)
- heteronuclear multiple bond coherence (HMBC)
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear single quantum coherence (HSQC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- mass spectrometry (MS)
- correlation spectroscopy (COSY)
- distortionless enhancement with polarization transfer (DEPT)
- infrared absorption spectroscopy (IR)
-
1-hydroxyanthracene-9,10-dione Molecule
InChIKey BTLXPCBPYBNQNR-UHFFFAOYSA-N Molecular Formula C14H8O3
Related Dataset(s)
- heteronuclear multiple bond coherence (HMBC)
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 1-Hydroxyanthraquinone; APCI-ITFT; MS2; CE: 35%; R=30000; [M+H]+
- heteronuclear single quantum coherence (HSQC)
- 1-Hydroxyanthraquinone; APCI-ITFT; MS2; CE: 35%; R=30000; [M]-
- correlation spectroscopy (COSY)
- distortionless enhancement with polarization transfer (DEPT)
- 1-Hydroxyanthraquinone; ESI-ITFT; MS2; CE: 35%; R=30000; [M-H]-
- 1-Hydroxyanthraquinone; ESI-ITFT; MS2; CE: 35%; R=30000; [M+H]+
- 1-Hydroxyanthraquinone; LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
-
1-iodo-2-phenoxybenzene Molecule
InChIKey AOZLGVLVAJRLPS-UHFFFAOYSA-N Molecular Formula C12H9IO
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- mass spectrometry (MS)
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear multiple bond coherence (HMBC)
- correlation spectroscopy (COSY)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- infrared absorption spectroscopy (IR)
- heteronuclear single quantum coherence (HSQC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
-
1-iodo-3,5-dimethylbenzene Molecule
InChIKey ZLMKEENUYIUKKC-UHFFFAOYSA-N Molecular Formula C8H9I
Related Dataset(s)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- heteronuclear single quantum coherence (HSQC)
- heteronuclear multiple bond coherence (HMBC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- distortionless enhancement with polarization transfer (DEPT)
- distortionless enhancement with polarization transfer (DEPT)
- correlation spectroscopy (COSY)
-
10-naphthalen-1-ylphenoxazine Molecule
InChIKey WXBQPLNOHBEVJJ-UHFFFAOYSA-N Molecular Formula C22H15NO
Related Dataset(s)
- heteronuclear multiple bond coherence (HMBC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- infrared absorption spectroscopy (IR)
- distortionless enhancement with polarization transfer (DEPT)
- distortionless enhancement with polarization transfer (DEPT)
- correlation spectroscopy (COSY)
- heteronuclear single quantum coherence (HSQC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- mass spectrometry (MS)
-
10H-phenoxazine Molecule
InChIKey TZMSYXZUNZXBOL-UHFFFAOYSA-N Molecular Formula C12H9NO
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- distortionless enhancement with polarization transfer (DEPT)
- correlation spectroscopy (COSY)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- heteronuclear multiple bond coherence (HMBC)
- heteronuclear single quantum coherence (HSQC)
-
11-[4-[3,6-bis(9,9-dimethylacridin-10-yl)phenanthro[9,10-b]quinoxalin-11-yl]-... Molecule
InChIKey MIKRQTHONBNINE-UHFFFAOYSA-N Molecular Formula C108H82N8
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- ultraviolet-visible spectrophotometry (UV-VIS)
- electrospray ionisation quadrupole detection (ESI Q Trap)
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- heteronuclear multiple bond coherence (HMBC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- infrared absorption spectroscopy (IR)
- correlation spectroscopy (COSY)
- heteronuclear single quantum coherence (HSQC)
-
11-bromo-3,6-bis(9,9-dimethylacridin-10-yl)phenanthro[9,10-b]quinoxaline Molecule
InChIKey YAWJSPVIHVBBHI-UHFFFAOYSA-N Molecular Formula C50H37BrN4
Related Dataset(s)
- heteronuclear multiple bond coherence (HMBC)
- infrared absorption spectroscopy (IR)
- distortionless enhancement with polarization transfer (DEPT)
- distortionless enhancement with polarization transfer (DEPT)
- correlation spectroscopy (COSY)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- ultraviolet-visible spectrophotometry (UV-VIS)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- electrospray ionisation quadrupole detection (ESI Q Trap)
- heteronuclear single quantum coherence (HSQC)
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19-bromo-5,10-bis(9,9-dimethylacridin-10-yl)-15,17,22-triazapentacyclo[12.8.0... Molecule
InChIKey BVKRGULQAWQNAW-UHFFFAOYSA-N Molecular Formula C49H36BrN5
Related Dataset(s)
- heteronuclear single quantum coherence (HSQC)
- infrared absorption spectroscopy (IR)
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear multiple bond coherence (HMBC)
- electrospray ionisation quadrupole detection (ESI Q Trap)
- correlation spectroscopy (COSY)
- ultraviolet-visible spectrophotometry (UV-VIS)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
-
1H-imidazole Molecule
InChIKey RAXXELZNTBOGNW-UHFFFAOYSA-N Molecular Formula C3H4N2
Related Dataset(s)
- Imidazole; ESI-QTOF; MS2; CE: 10; [M-H]-
- Imidazole; LC-ESI-QQ; MS2; CE:10 V; [M+H]+
- Imidazole; LC-ESI-QQ; MS2; CE:50 V; [M+H]+
- Imidazole; ESI-QTOF; MS2; CE: 40; [M+H]+
- Imidazole; ESI-QTOF; MS2; CE: 10; [M+H]+
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- Imidazole; LC-ESI-QQ; MS2; CE:30 V; [M+H]+
- Imidazole; LC-ESI-QQ; MS2; CE:40 V; [M+H]+
- IMIDAZOLE; EI-B; MS
- Imidazole; ESI-QTOF; MS2; CE: 20; [M-H]-
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear single quantum coherence (HSQC)
- correlation spectroscopy (COSY)
- Imidazole; LC-ESI-QQ; MS2; CE:20 V; [M+H]+
- Imidazole; ESI-QTOF; MS2; CE: 20; [M+H]+
- heteronuclear multiple bond coherence (HMBC)
- Imidazole; LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M+H]+
-
2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluoro-1-(2-phenyl-1-propylindol-3-yl)... Molecule
InChIKey HZWGYARODZYKRN-UHFFFAOYSA-N Molecular Formula C25H16F15NO
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- ultraviolet-visible spectrophotometry (UV-VIS)
- heteronuclear multiple bond coherence (HMBC)
- mass spectrometry (MS)
- infrared absorption spectroscopy (IR)
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 19F nuclear magnetic resonance spectroscopy (19F NMR)
- heteronuclear single quantum coherence (HSQC)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
-
2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluoro-1-[1-[(2-methylphenyl)methyl]-2... Molecule
InChIKey KTPIZOYTZMBWTA-UHFFFAOYSA-N Molecular Formula C30H18F15NO
Related Dataset(s)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- heteronuclear multiple bond coherence (HMBC)
- infrared absorption spectroscopy (IR)
- distortionless enhancement with polarization transfer (DEPT)
- mass spectrometry (MS)
- correlation spectroscopy (COSY)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 19F nuclear magnetic resonance spectroscopy (19F NMR)
- distortionless enhancement with polarization transfer (DEPT)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- heteronuclear single quantum coherence (HSQC)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
-
2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluoro-1-[1-[(4-fluorophenyl)methyl]-2... Molecule
InChIKey SRVNGHRZKVBEMJ-UHFFFAOYSA-N Molecular Formula C30H17F16NO2
Related Dataset(s)
- infrared absorption spectroscopy (IR)
- distortionless enhancement with polarization transfer (DEPT)
- 19F nuclear magnetic resonance spectroscopy (19F NMR)
- heteronuclear single quantum coherence (HSQC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- mass spectrometry (MS)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- ultraviolet-visible spectrophotometry (UV-VIS)
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear multiple bond coherence (HMBC)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
-
2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluoro-1-[1-[(4-fluorophenyl)methyl]-2... Molecule
InChIKey QOXYOJVMQMEDIX-UHFFFAOYSA-N Molecular Formula C29H15F16NO
Related Dataset(s)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- heteronuclear multiple bond coherence (HMBC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- heteronuclear single quantum coherence (HSQC)
- diffraction method (crystallography)
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- ultraviolet-visible spectrophotometry (UV-VIS)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 19F nuclear magnetic resonance spectroscopy (19F NMR)
- mass spectrometry (MS)
- infrared absorption spectroscopy (IR)
- distortionless enhancement with polarization transfer (DEPT)
