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methyl 2-acetamido-3-benzoylsulfanylpropanoate Molecule
InChIKey ZRVOQODFFUWOCD-UHFFFAOYSA-N Molecular Formula C13H15NO4S
Related Dataset(s)
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methyl 3-bromopropanoate Molecule
InChIKey KQEVIFKPZOGBMZ-UHFFFAOYSA-N Molecular Formula C4H7BrO2
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- distortionless enhancement with polarization transfer (DEPT)
- correlation spectroscopy (COSY)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
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methyl 4-(5,6-dicyano-1-propylbenzimidazol-2-yl)benzoate Molecule
InChIKey DXIBAQPVFFVWMB-UHFFFAOYSA-N Molecular Formula C20H16N4O2
Related Dataset(s)
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methyl 4-(5,6-dicyano-1H-benzimidazol-2-yl)benzoate Molecule
InChIKey BLFQAPUPZTZFGB-UHFFFAOYSA-N Molecular Formula C17H10N4O2
Related Dataset(s)
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methyl 4-[1-hydroxy-2-(4-methoxycarbonylphenyl)-2-oxoethyl]benzoate Molecule
InChIKey XFRIKHRKYHJNTP-UHFFFAOYSA-N Molecular Formula C18H16O6
Related Dataset(s)
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methyl 4-[1-hydroxy-2-(4-methoxycarbonylphenyl)-2-oxoethyl]benzoate Molecule
InChIKey XFRIKHRKYHJNTP-UHFFFAOYSA-N Molecular Formula C18H16O6
Related Dataset(s)
- infrared absorption spectroscopy (IR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- mass spectrometry (MS)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
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methyl 4-[3-[(E)-2-[4-[(E)-2-[6,7-bis(4-methoxycarbonylphenyl)-3-[(E)-2-[3-[(... Molecule
InChIKey PUECKUBSTSEMFV-JZCOKTKISA-N Molecular Formula C138H114N12O10
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- mass spectrometry (MS)
- ultraviolet-visible spectrophotometry (UV-VIS)
- infrared absorption spectroscopy (IR)
- distortionless enhancement with polarization transfer (DEPT)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- correlation spectroscopy (COSY)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- ultraviolet-visible spectrophotometry (UV-VIS)
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methyl 4-[4,5-diamino-2-(4-methoxycarbonylphenyl)phenyl]benzoate Molecule
InChIKey GDNXABGKDRYTLH-UHFFFAOYSA-N Molecular Formula C22H20N2O4
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- infrared absorption spectroscopy (IR)
- mass spectrometry (MS)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- correlation spectroscopy (COSY)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- distortionless enhancement with polarization transfer (DEPT)
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methyl 4-[6,7-diazido-3-(trifluoromethyl)quinoxalin-2-yl]benzoate Molecule
InChIKey KFNATYUQWUQIDP-UHFFFAOYSA-N Molecular Formula C17H9F3N8O2
Related Dataset(s)
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methyl 4-[6,7-difluoro-3-(trifluoromethyl)quinoxalin-2-yl]benzoate Molecule
InChIKey GWVZDEWKQUUMGB-UHFFFAOYSA-N Molecular Formula C17H9F5N2O2
Related Dataset(s)
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methyl 4-bromo-3,5-dimethoxybenzoate Molecule
InChIKey DBPNSECLVZPWET-UHFFFAOYSA-N Molecular Formula C10H11BrO4
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)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- distortionless enhancement with polarization transfer (DEPT)
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methyl 6-bromo-1-[(4-methoxyphenyl)methyl]indole-4-carboxylate Molecule
InChIKey NSLHWLLKHINCSE-UHFFFAOYSA-N Molecular Formula C18H16BrNO3
Related Dataset(s)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- infrared absorption spectroscopy (IR)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- mass spectrometry (MS)
- distortionless enhancement with polarization transfer (DEPT)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
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methyl prop-2-ynoate Molecule
InChIKey IMAKHNTVDGLIRY-UHFFFAOYSA-N Molecular Formula C4H4O2
Related Dataset(s)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- distortionless enhancement with polarization transfer (DEPT)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- correlation spectroscopy (COSY)
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nfdi4chem-mol1019 (Unknown Molecule) Molecule
InChIKey MSWWFXVWFILBNM-UHFFFAOYSA-L Molecular Formula C68H56Cu2I2N4P4
Related Dataset(s)
- single crystal X-ray diffraction (single-crystal X-ray diffraction)
- 31P nuclear magnetic resonance spectroscopy (31P NMR)
- electrospray ionisation mass spectrometry (ESMS)
- infrared absorption spectroscopy (IR)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
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nfdi4chem-mol1024 (Unknown Molecule) Molecule
InChIKey SMDRKVWNQXOQTQ-SHHOIMCASA-N Molecular Formula C22H32N6O
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- fast-atom bombardment mass spectrometry (FABMS)
- distortionless enhancement with polarization transfer (DEPT)
- 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)
- infrared absorption spectroscopy (IR)
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nfdi4chem-mol1098 (Unknown Molecule) Molecule
InChIKey OTKUMVPKUYFCDX-CYYJNZCTSA-N Molecular Formula C22H17BrF2N2
Related Dataset(s)
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nfdi4chem-mol1357 (Unknown Molecule) Molecule
InChIKey LCYWCZWKUOWKCQ-OQLLNIDSSA-N Molecular Formula C13H10N2O
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- mass spectrometry (MS)
- infrared absorption spectroscopy (IR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- distortionless enhancement with polarization transfer (DEPT)
- 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)
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nfdi4chem-mol1363 (Unknown Molecule) Molecule
InChIKey GJCGJBZILFUNOT-QXWNKERDSA-N Molecular Formula C48H36CuF3N2OP2
Related Dataset(s)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- Fourier transform infrared spectroscopy (FTIR)
- single crystal X-ray diffraction (single-crystal X-ray diffraction)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- proton-decoupled 31P nuclear magnetic resonance spectroscopy (31P{1H}-NMR)
- fast-atom bombardment mass spectrometry (FABMS)
- elemental analysis (EA)
- 19F nuclear magnetic resonance spectroscopy (19F NMR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
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nfdi4chem-mol1389 (Unknown Molecule) Molecule
InChIKey FJGPNDURHCLNNX-IIFGQYIMSA-N Molecular Formula C53H38N6
Related Dataset(s)
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nfdi4chem-mol1599 (Unknown Molecule) Molecule
InChIKey LRHQVSJDOPYCOR-UHFFFAOYSA-M Molecular Formula C47H45ClN3PPd
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)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- fast-atom bombardment mass spectrometry (FABMS)
- attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)
- high resolution fast-atom bombardment mass spectrometry (HRFABMS)