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(1-benzyl-2-phenylindol-3-yl)-(2,3,4,5,6-pentafluorophenyl)methanone Molecule
InChIKey JSFGZCLKZHTGQA-UHFFFAOYSA-N Molecular Formula C28H16F5NO
Related Dataset(s)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- distortionless enhancement with polarization transfer (DEPT)
- ultraviolet-visible spectrophotometry (UV-VIS)
- 19F nuclear magnetic resonance spectroscopy (19F NMR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- diffraction method (crystallography)
- infrared absorption spectroscopy (IR)
- mass spectrometry (MS)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- heteronuclear single quantum coherence (HSQC)
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear multiple bond coherence (HMBC)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
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(1-methyl-2-oxoquinolin-4-yl) benzoate Molecule
InChIKey PWOZFWCPCCAGPJ-UHFFFAOYSA-N Molecular Formula C17H13NO3
Related Dataset(s)
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(1R,4aS,10aR)-1,4a-dimethyl-9-oxo-7-propan-2-yl-3,4,10,10a-tetrahydro-2H-phen... Molecule
InChIKey MSWJSDLNPCSSNW-MISYRCLQSA-N Molecular Formula C20H26O3
Related Dataset(s)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 1H--1H nuclear Overhauser enhancement spectroscopy (1H-1H NOESY)
- nuclear magnetic resonance spectroscopy (NMR)
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(1R,4aS,10aR)-7-(1-hydroxypropan-2-yl)-1,4a-dimethyl-9-oxo-3,4,10,10a-tetrahy... Molecule
InChIKey RNTLHJYRNWIHOP-HVNDSYIDSA-N Molecular Formula C20H26O4
Related Dataset(s)
- 1H--1H nuclear Overhauser enhancement spectroscopy (1H-1H NOESY)
- nuclear magnetic resonance spectroscopy (NMR)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- high-resolution electrospray ionisation time-of-flight mass spectrometry (HR-ESI-TOF-MS)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
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(1R,4aS,10aR)-7-(2-hydroxypropan-2-yl)-1,4a-dimethyl-9-oxo-3,4,10,10a-tetrahy... Molecule
InChIKey MXPXAZNVQUWDFH-NSISKUIASA-N Molecular Formula C20H26O4
Related Dataset(s)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H--1H nuclear Overhauser enhancement spectroscopy (1H-1H NOESY)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1H--1H correlation spectroscopy (1H-1H COSY)
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(1R,4aS,9S,10aR)-9-hydroxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahyd... Molecule
InChIKey GPFVBJYXFRIOFB-ONCXSQPRSA-N Molecular Formula C20H28O3
Related Dataset(s)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- nuclear magnetic resonance spectroscopy (NMR)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 1H--1H nuclear Overhauser enhancement spectroscopy (1H-1H NOESY)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
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(1S)-1-phenylethanol Molecule
InChIKey WAPNOHKVXSQRPX-ZETCQYMHSA-N Molecular Formula C8H10O
Related Dataset(s)
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(2,2-dimethylchromen-6-yl)methanol Molecule
InChIKey QNBPDVUHGIPLIS-UHFFFAOYSA-N Molecular Formula C12H14O2
Related Dataset(s)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- infrared absorption spectroscopy (IR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- distortionless enhancement with polarization transfer (DEPT)
- distortionless enhancement with polarization transfer (DEPT)
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(2-methylsulfanylphenyl)boronic acid Molecule
InChIKey QXBWTYBCNFKURT-UHFFFAOYSA-N Molecular Formula C7H9BO2S
Related Dataset(s)
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(2-oxo-1H-quinolin-4-yl) benzoate Molecule
InChIKey OLBOUCJZXKDPSO-UHFFFAOYSA-N Molecular Formula C16H11NO3
Related Dataset(s)
- infrared absorption spectroscopy (IR)
- electrospray ionisation mass spectrometry (ESMS)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 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)
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(2-oxochromen-4-yl) benzoate Molecule
InChIKey XJVHOURXXNKDMD-UHFFFAOYSA-N Molecular Formula C16H10O4
Related Dataset(s)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- infrared absorption spectroscopy (IR)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- electrospray ionisation mass spectrometry (ESMS)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H--1H correlation spectroscopy (1H-1H COSY)
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(2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-oxo-5-prop-2-enoxypentanoic acid Molecule
InChIKey LRBARFFNYOKIAX-HXUWFJFHSA-N Molecular Formula C23H23NO6
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
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(2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)hexanoic acid Molecule
InChIKey VCFCFPNRQDANPN-LJQANCHMSA-N Molecular Formula C21H23NO4
Related Dataset(s)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- distortionless enhancement with polarization transfer (DEPT)
- distortionless enhancement with polarization transfer (DEPT)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H--1H correlation spectroscopy (1H-1H COSY)
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(2R)-6-[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)ethylamino]-2-(9H-fluoren-9-... Molecule
InChIKey ZPSRBXWVBNVFTO-RUZDIDTESA-N Molecular Formula C31H36N2O6
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- distortionless enhancement with polarization transfer (DEPT)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H--1H correlation spectroscopy (1H-1H COSY)
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(2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-propan-2-ylsulfanyloxane-3,4,5-triol Molecule
InChIKey BPHPUYQFMNQIOC-NXRLNHOXSA-N Molecular Formula C9H18O5S
Related Dataset(s)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- distortionless enhancement with polarization transfer (DEPT)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- distortionless enhancement with polarization transfer (DEPT)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1H--1H correlation spectroscopy (1H-1H COSY)
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(2S)-2-amino-3-hydroxypropanoic acid Molecule
InChIKey MTCFGRXMJLQNBG-REOHCLBHSA-N Molecular Formula C3H7NO3
Related Dataset(s)
- L-Serine; LC-ESI-QTOF; MS2; CE: 40; R=; [M+H]+
- L-Serine; LC-ESI-ITFT; MS2; m/z:104.04; NEG
- L-Serine; LC-ESI-QQ; MS2; CE:20 V; [M-H]-
- 1H--1H correlation spectroscopy (1H-1H COSY)
- L-Serine; LC-ESI-QQ; MS2; CE:40 V; [M-H]-
- L-Serine; LC-ESI-ITFT; MS2; m/z:104.04; NEG
- L-Serine; GC-EI-TOF; MS; 3 TMS; n TMS; RT:472.656 sec
- L-Serine; LC-ESI-QQ; MS2; CE:40 V; [M+H]+
- L-Serine; LC-ESI-QQ; MS2; CE:30 V; [M+H]+
- L-Serine; GC-EI-TOF; MS; 3 TMS; BP:73
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- L-Serine; LC-ESI-ITFT; MS2; m/z:106.05; POS
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- distortionless enhancement with polarization transfer (DEPT)
- L-Serine; CE-ESI-TOF; MS; [M+H]+
- L-Serine; GC-EI-TOF; MS; 3 TMS; BP:204
- L-Serine; GC-EI-QQ; MS; 3 TBDMS; RT:760.32 sec
- L-Serine; EI-B; MS; 2 TMS; RT: 440.66 s
- L-Serine; LC-ESI-ITFT; MS; POS
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- L-Serine; EI-B; MS; 3 TMS; RT: 506.89 s
- L-Serine; LC-ESI-ITFT; MS2; m/z:106.05; POS
- L-Serine; LC-ESI-QQ; MS2; CE:10 V; [M-H]-
- L-Serine; LC-ESI-QTOF; MS2; CE: 20; R=; [M+H]+
- L-Serine; LC-ESI-QQ; MS2; CE:50 V; [M+H]+
- L-Serine; LC-ESI-QQ; MS2; CE:30 V; [M-H]-
- L-Serine; LC-ESI-ITFT; MS2; m/z:104.07; POS
- distortionless enhancement with polarization transfer (DEPT)
- L-Serine; GC-EI-TOF; MS; 2 TMS; n TMS; RT:416.207 sec
- L-Serine; LC-ESI-QQ; MS2; CE:20 V; [M+H]+
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- L-Serine; GC-EI-TOF; MS; 3 TMS; BP:204
- L-Serine; LC-ESI-QQ; MS2; CE:10 V; [M+H]+
- L-Serine; LC-ESI-QTOF; MS2; CE: 10; R=; [M+H]+
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(3-phenylphenyl)methanamine Molecule
InChIKey WKHABRRJMGVELW-UHFFFAOYSA-N Molecular Formula C13H13N
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 nuclear magnetic resonance spectroscopy (1H NMR)
- distortionless enhancement with polarization transfer (DEPT)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- distortionless enhancement with polarization transfer (DEPT)
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(3S)-10-(4-aminobutyl)-3,7-dibenzyl-1-[(4-chlorophenyl)methyl]-1,4,7,10-tetra... Molecule
InChIKey UPMQNWKRPRCIKT-LJAQVGFWSA-N Molecular Formula C33H38ClN5O4
Related Dataset(s)
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(3S)-7-(4-aminobutyl)-1,3,10-tribenzyl-1,4,7,10-tetrazacyclododecane-2,5,8,11... Molecule
InChIKey HONYLTJZEWJOCQ-LJAQVGFWSA-N Molecular Formula C33H39N5O4
Related Dataset(s)
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(3S)-7-(4-aminobutyl)-3,10-dibenzyl-1-butyl-1,4,7,10-tetrazacyclododecane-2,5... Molecule
InChIKey VHEMXQONFXCHOC-SANMLTNESA-N Molecular Formula C30H41N5O4
Related Dataset(s)
