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1-(1-benzyl-5-methylpyrazol-3-yl)-4-butyltriazole Molecule
InChIKey PKNOMBYYAWYDCG-UHFFFAOYSA-N Molecular Formula C17H21N5
Related Dataset(s)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- infrared absorption spectroscopy (IR)
- mass spectrometry (MS)
- heteronuclear single quantum coherence (HSQC)
- distortionless enhancement with polarization transfer (DEPT)
- correlation spectroscopy (COSY)
- heteronuclear multiple bond coherence (HMBC)
- distortionless enhancement with polarization transfer (DEPT)
-
1-(1-benzylpyrazol-3-yl)-4-(4-methoxyphenyl)triazole Molecule
InChIKey JMPSOWDQCFVJPL-UHFFFAOYSA-N Molecular Formula C19H17N5O
Related Dataset(s)
- heteronuclear multiple bond coherence (HMBC)
- heteronuclear single quantum coherence (HSQC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- correlation spectroscopy (COSY)
- mass spectrometry (MS)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- distortionless enhancement with polarization transfer (DEPT)
- distortionless enhancement with polarization transfer (DEPT)
- infrared absorption spectroscopy (IR)
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1-(1-cyclopentylpyrazol-3-yl)-4-(4-methoxyphenyl)triazole Molecule
InChIKey SYHGOJNCDVCRGL-UHFFFAOYSA-N Molecular Formula C17H19N5O
Related Dataset(s)
- infrared absorption spectroscopy (IR)
- mass spectrometry (MS)
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- heteronuclear single quantum coherence (HSQC)
- heteronuclear multiple bond coherence (HMBC)
- distortionless enhancement with polarization transfer (DEPT)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
-
1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one Molecule
InChIKey DXDRHHKMWQZJHT-UHFFFAOYSA-N Molecular Formula C15H12O4
Related Dataset(s)
- YAC_3P (Compound 19) Isoliquiritigenin[15]
- isoliquiritigenin; LC-ESI-QTOF; MS2
- isoliquiritigenin; LC-ESI-QTOF; MS2
- YAC_3P (Compound 19) Isoliquiritigenin[17]
- isoliquiritigenin; LC-ESI-QTOF; MS2
- 2',4,4'-Trihydroxychalcone; LC-ESI-QTOF; MS2
- isoliquiritigenin; LC-ESI-QTOF; MS2
- isoliquiritigenin; LC-ESI-QTOF; MS2
- isoliquiritigenin; LC-ESI-QTOF; MS2
- YAC_3P (Compound 19) Isoliquiritigenin[16]
- YAC_3P (Compound 19) Isoliquiritigenin[11]
- YAC_3P (Compound 19) Isoliquiritigenin[99999]
- isoliquiritigenin; LC-ESI-QTOF; MS2
- 2',4,4'-Trihydroxychalcone; LC-ESI-QTOF; MS2
- isoliquiritigenin; LC-ESI-QTOF; MS2
- YAC_3P (Compound 19) Isoliquiritigenin[14]
- isoliquiritigenin; LC-ESI-QTOF; MS2
- isoliquiritigenin; LC-ESI-QTOF; MS2
- isoliquiritigenin; LC-ESI-QTOF; MS2
- YAC_3P (Compound 19) Isoliquiritigenin[12]
- YAC_3P (Compound 19) Isoliquiritigenin[13]
- isoliquiritigenin; LC-ESI-QTOF; MS2
-
1-(2,6-dihydroxyphenyl)ethanone Molecule
InChIKey YPTJKHVBDCRKNF-UHFFFAOYSA-N Molecular Formula C8H8O3
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear single quantum coherence (HSQC)
- 2,6-Dihydroxyacetophenone; LC-ESI-QTOF; MS
- 2,6-Dihydroxyacetophenone; LC-ESI-QTOF; MS2; CE:20 eV; [M-H]-
- 2,6-Dihydroxyacetophenone; LC-ESI-QTOF; MS2; CE:10 eV; [M-H]-
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear multiple bond coherence (HMBC)
- correlation spectroscopy (COSY)
- 2',6'-DIHYDROXYACETOPHENONE; EI-B; MS
- 2,6-Dihydroxyacetophenone; LC-ESI-QTOF; MS2; CE:30 eV; [M-H]-
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
-
1-(3,4-dichlorophenyl)ethanone Molecule
InChIKey WBPAOUHWPONFEQ-UHFFFAOYSA-N Molecular Formula C8H6Cl2O
Related Dataset(s)
- heteronuclear multiple bond coherence (HMBC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- distortionless enhancement with polarization transfer (DEPT)
- 3',4'-DICHLOROACETOPHENONE; EI-B; MS
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- correlation spectroscopy (COSY)
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear single quantum coherence (HSQC)
-
1-(3,5-dibromo-2,6-dihydroxyphenyl)ethanone Molecule
InChIKey GHPWLLSLLWHDPT-UHFFFAOYSA-N Molecular Formula C8H6Br2O3
Related Dataset(s)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- heteronuclear single quantum coherence (HSQC)
- mass spectrometry (MS)
- correlation spectroscopy (COSY)
- distortionless enhancement with polarization transfer (DEPT)
- distortionless enhancement with polarization transfer (DEPT)
- infrared absorption spectroscopy (IR)
- heteronuclear multiple bond coherence (HMBC)
-
1-(3-bromo-2,6-dihydroxyphenyl)ethanone Molecule
InChIKey MZSDKOBKEFEBJF-UHFFFAOYSA-N Molecular Formula C8H7BrO3
Related Dataset(s)
- mass spectrometry (MS)
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- heteronuclear single quantum coherence (HSQC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- correlation spectroscopy (COSY)
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear multiple bond coherence (HMBC)
- infrared absorption spectroscopy (IR)
-
1-(3-bromophenyl)ethanone Molecule
InChIKey JYAQYXOVOHJRCS-UHFFFAOYSA-N Molecular Formula C8H7BrO
Related Dataset(s)
- heteronuclear multiple bond coherence (HMBC)
- 3-BROMOPHENYL METHYL KETONE; EI-B; MS
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear single quantum coherence (HSQC)
- 3'-BROMOACETOPHENONE; EI-B; MS
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
- correlation spectroscopy (COSY)
- M-BROMOACETOPHENONE; EI-B; MS
- M-BROMOACETOPHENONE; EI-B; MS
-
1-(4-cyanobutyl)-N-(2-phenylpropan-2-yl)indazole-3-carboxamide Molecule
InChIKey JGTSOWOPISVAHG-UHFFFAOYSA-N
Related Dataset(s)
-
1-(4-fluoro-2-hydroxyphenyl)ethanone Molecule
InChIKey HLTBTUXAMVOKIH-UHFFFAOYSA-N Molecular Formula C8H7FO2
Related Dataset(s)
- heteronuclear multiple bond coherence (HMBC)
- heteronuclear single quantum coherence (HSQC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
- 19F nuclear magnetic resonance spectroscopy (19F NMR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- distortionless enhancement with polarization transfer (DEPT)
- correlation spectroscopy (COSY)
-
1-(4-fluoro-3-hydroxyphenyl)ethanone Molecule
InChIKey WZADRGNQKQFMHI-UHFFFAOYSA-N Molecular Formula C8H7FO2
Related Dataset(s)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- correlation spectroscopy (COSY)
- heteronuclear single quantum coherence (HSQC)
- heteronuclear multiple bond coherence (HMBC)
- distortionless enhancement with polarization transfer (DEPT)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
- 19F nuclear magnetic resonance spectroscopy (19F NMR)
-
1-(4-methoxyphenyl)ethanone Molecule
InChIKey NTPLXRHDUXRPNE-UHFFFAOYSA-N Molecular Formula C9H10O2
Related Dataset(s)
- correlation spectroscopy (COSY)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- distortionless enhancement with polarization transfer (DEPT)
- 4-METHOXYACETOPHENONE; EI-B; MS
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
- P-METHOXYACETOPHENONE; EI-B; MS
- heteronuclear multiple bond coherence (HMBC)
- heteronuclear single quantum coherence (HSQC)
- 4-METHOXYPHENYL METHYL KETONE; EI-B; MS
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
-
1-(4-methylpyridin-2-yl)ethanone Molecule
InChIKey HRVQMQWVGKYDCF-UHFFFAOYSA-N Molecular Formula C8H9NO
Related Dataset(s)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- heteronuclear multiple bond coherence (HMBC)
- heteronuclear single quantum coherence (HSQC)
- distortionless enhancement with polarization transfer (DEPT)
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- correlation spectroscopy (COSY)
-
1-(5-fluoropentyl)-N-(2-phenylpropan-2-yl)indole-3-carboxamide Molecule
InChIKey ZJCYQNSYQBCKOD-UHFFFAOYSA-N
Related Dataset(s)
-
1-(5-fluoropentyl)-N-naphthalen-1-ylindole-3-carboxamide Molecule
InChIKey DJKVOBZLMBHFKX-UHFFFAOYSA-N
Related Dataset(s)
-
1-(5-methyl-1H-pyrazol-3-yl)-4-phenyltriazole Molecule
InChIKey BTYPCTNIHDBBSH-UHFFFAOYSA-N Molecular Formula C12H11N5
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- heteronuclear single quantum coherence (HSQC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- mass spectrometry (MS)
- distortionless enhancement with polarization transfer (DEPT)
- infrared absorption spectroscopy (IR)
- heteronuclear multiple bond coherence (HMBC)
-
1-(6-methylpyridin-2-yl)ethanone Molecule
InChIKey FPQMUQPPAYCAME-UHFFFAOYSA-N Molecular Formula C8H9NO
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- correlation spectroscopy (COSY)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- heteronuclear single quantum coherence (HSQC)
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- heteronuclear multiple bond coherence (HMBC)
-
1-N,2-N-dimethylbenzene-1,2-diamine Molecule
InChIKey UMAPFAAAQBMYNJ-UHFFFAOYSA-N Molecular Formula C8H12N2
Related Dataset(s)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- heteronuclear single quantum coherence (HSQC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear multiple bond coherence (HMBC)
- distortionless enhancement with polarization transfer (DEPT)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- correlation spectroscopy (COSY)
-
1-[(3,5-difluorophenyl)methyl]-5-[(E)-[di(propan-2-yl)amino]diazenyl]pyrazole... Molecule
InChIKey ZFEWCQZPKGQXCJ-GHVJWSGMSA-N Molecular Formula C17H20F2N6
Related Dataset(s)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- infrared absorption spectroscopy (IR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- mass spectrometry (MS)
- heteronuclear multiple bond coherence (HMBC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
- 19F nuclear magnetic resonance spectroscopy (19F NMR)
- X-ray diffraction (XRD)
- infrared absorption spectroscopy (IR)
- distortionless enhancement with polarization transfer (DEPT)
- process
- electron ionisation mass spectrometry (EI-MS)
- heteronuclear single quantum coherence (HSQC)
