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2-ethynylpyridine Molecule
InChIKey NHUBNHMFXQNNMV-UHFFFAOYSA-N Molecular Formula C7H5N
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 multiple bond coherence (13C-1H HMBC)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- distortionless enhancement with polarization transfer (DEPT)
- 1H--1H correlation spectroscopy (1H-1H COSY)
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2-fluoro-4-(3-fluoro-4-iodophenyl)-1-[4-[(3R)-3-methylpentyl]phenyl]benzene Molecule
InChIKey FOYZQZHRDUIOMK-MRXNPFEDSA-N Molecular Formula C24H23F2I
Related Dataset(s)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- electrospray ionisation mass spectrometry (ESMS)
- infrared absorption spectroscopy (IR)
- distortionless enhancement with polarization transfer (DEPT)
- distortionless enhancement with polarization transfer (DEPT)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 19F nuclear magnetic resonance spectroscopy (19F NMR)
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2-hydroxy-3-methyl-6-propan-2-ylbenzaldehyde Molecule
InChIKey LLVQQQQUKUEOOW-UHFFFAOYSA-N Molecular Formula C11H14O2
Related Dataset(s)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- elemental analysis (EA)
- distortionless enhancement with polarization transfer (DEPT)
- electrospray ionisation quadrupole detection (ESI Q Trap)
- infrared absorption spectroscopy (IR)
- distortionless enhancement with polarization transfer (DEPT)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
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2-hydroxy-5-(4-hydroxy-3,6-dioxo-2,5-diphenylcyclohexa-1,4-dien-1-yl)-3,6-dip... Molecule
InChIKey JIJBMATWFKIPNS-UHFFFAOYSA-N Molecular Formula C36H22O6
Related Dataset(s)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- high-resolution electrospray ionisation time-of-flight mass spectrometry (HR-ESI-TOF-MS)
- attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- nuclear magnetic resonance spectroscopy (NMR)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 1H--1H nuclear Overhauser enhancement spectroscopy (1H-1H NOESY)
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2-iodobenzoic acid Molecule
InChIKey CJNZAXGUTKBIHP-UHFFFAOYSA-N Molecular Formula C7H5IO2
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- 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)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- ORTHO-IODOBENZOIC ACID; EI-B; MS
- 2-IODOBENZOIC ACID; EI-B; MS
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2-methoxyethyl 6-(2-methoxyethoxy)-1-[(4-methoxyphenyl)methyl]indole-4-carbox... Molecule
InChIKey NXWRTJITFCCXAG-UHFFFAOYSA-N Molecular Formula C23H27NO6
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- infrared absorption spectroscopy (IR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- mass spectrometry (MS)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- distortionless enhancement with polarization transfer (DEPT)
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2-methyl-3,4-dihydro-2H-naphthalen-1-one Molecule
InChIKey GANIBVZSZGNMNB-UHFFFAOYSA-N Molecular Formula C11H12O
Related Dataset(s)
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2-methyl-3-[4-(3-methylquinoxalin-2-yl)phenyl]quinoxaline Molecule
InChIKey CJMZWSARABXOSW-UHFFFAOYSA-N Molecular Formula C24H18N4
Related Dataset(s)
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2-oxo-3-(trifluoromethyl)-1H-quinoxaline-6-carboxylic acid Molecule
InChIKey QCOIWEBIQVDGKJ-UHFFFAOYSA-N Molecular Formula C10H5F3N2O3
Related Dataset(s)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- mass spectrometry (MS)
- infrared absorption spectroscopy (IR)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 19F nuclear magnetic resonance spectroscopy (19F NMR)
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2-tert-butyl-N-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaeny... Molecule
InChIKey DLPQSZHKSNBIBG-UHFFFAOYSA-N Molecular Formula C27H29N3
Related Dataset(s)
- fast-atom bombardment mass spectrometry (FABMS)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- high resolution fast-atom bombardment mass spectrometry (HRFABMS)
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3,3-dimethylpentanedioic acid Molecule
InChIKey DUHQIGLHYXLKAE-UHFFFAOYSA-N Molecular Formula C7H12O4
Related Dataset(s)
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3,4-bis[4,5-bis(5-methylthiophen-2-yl)thiophen-2-yl]-2,5-bis(5-bromothiophen-... Molecule
InChIKey IRGZYWXCPQUKOM-UHFFFAOYSA-N Molecular Formula C40H26Br2S9
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- distortionless enhancement with polarization transfer (DEPT)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 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--1H correlation spectroscopy (1H-1H COSY)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
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3,4-bis[4,5-bis[5-[4,5-bis(5-methylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]... Molecule
InChIKey HDFUPFKYSFSDEB-UHFFFAOYSA-N Molecular Formula C92H60S21
Related Dataset(s)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- distortionless enhancement with polarization transfer (DEPT)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
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3,4-dichlorobenzaldehyde Molecule
InChIKey ZWUSBSHBFFPRNE-UHFFFAOYSA-N Molecular Formula C7H4Cl2O
Related Dataset(s)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 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)
- distortionless enhancement with polarization transfer (DEPT)
- distortionless enhancement with polarization transfer (DEPT)
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3,4-dihydro-2H-naphthalen-1-one Molecule
InChIKey XHLHPRDBBAGVEG-UHFFFAOYSA-N Molecular Formula C10H10O
Related Dataset(s)
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3,4-dihydroxybenzaldehyde Molecule
InChIKey IBGBGRVKPALMCQ-UHFFFAOYSA-N Molecular Formula C7H6O3
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)
- Protocatechuic aldehyde; LC-ESI-QTOF; MS; CE:10 eV; [M-H]-
- Protocatechuic aldehyde; LC-ESI-QTOF; MS2; CE:20 eV; [M-H]-
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- Protocatechuic aldehyde; LC-ESI-QTOF; MS2; CE:10 eV; [M-H]-
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- Protocatechuic aldehyde; LC-ESI-QTOF; MS
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3,4-dimethylbenzaldehyde Molecule
InChIKey POQJHLBMLVTHAU-UHFFFAOYSA-N Molecular Formula C9H10O
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)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
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3,4-dimethylbenzenethiol Molecule
InChIKey IDKCKPBAFOIONK-UHFFFAOYSA-N Molecular Formula C8H10S
Related Dataset(s)
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3,5,6,8-tetrahydroxy-1-methyl-9,10-dioxo-7-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy... Molecule
InChIKey DGQLVPJVXFOQEV-JNVSTXMASA-N Molecular Formula C22H20O13
Related Dataset(s)
- Carminic acid; LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
- NMR_Bruker-FID[2]
- 1H--1H nuclear Overhauser enhancement spectroscopy (1H-1H NOESY)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- Carminic acid; LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
- Carminic acid; LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
- circular dichroism spectroscopy (CD spectrometry)
- NMR_Bruker-FID[6]
- ultraviolet-visible spectrophotometry (UV-VIS)
- Carminic acid; LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
- NMR_Bruker-FID[1]
- Carminic acid; LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-
- Carminic acid; LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
- NMR_Bruker-FID[5]
- ultraviolet-visible spectrophotometry (UV-VIS)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- electrospray ionisation tandem mass spectrometry (ESI-MS2)
- NMR_Bruker-FID[3]
- 1H--1H correlation spectroscopy (1H-1H COSY)
- NMR_Bruker-FID[4]
- ultraviolet-visible spectrophotometry (UV-VIS)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
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3,5-dihydroxybenzaldehyde Molecule
InChIKey HAQLHRYUDBKTJG-UHFFFAOYSA-N Molecular Formula C7H6O3
Related Dataset(s)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 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)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
