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methyl prop-2-ynoate Molecule
InChIKey IMAKHNTVDGLIRY-UHFFFAOYSA-N Molecular Formula C4H4O2
Related Dataset(s)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 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)
- correlation spectroscopy (COSY)
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nfdi4chem-mol1009 (Unknown Molecule) Molecule
InChIKey GJXVYPGROXVEAZ-LSDHQDQOSA-N Molecular Formula C18H24N6
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- infrared absorption spectroscopy (IR)
- distortionless enhancement with polarization transfer (DEPT)
- fast-atom bombardment mass spectrometry (FABMS)
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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)
- infrared absorption spectroscopy (IR)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- distortionless enhancement with polarization transfer (DEPT)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- fast-atom bombardment mass spectrometry (FABMS)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
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nfdi4chem-mol1081 (Unknown Molecule) Molecule
InChIKey PWDVDRMYMFXQOH-UHFFFAOYSA-N Molecular Formula C21H22
Related Dataset(s)
- correlation spectroscopy (COSY)
- heteronuclear single quantum coherence (HSQC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- heteronuclear multiple bond coherence (HMBC)
- distortionless enhancement with polarization transfer (DEPT)
- electrospray ionisation quadrupole detection (ESI Q Trap)
- distortionless enhancement with polarization transfer (DEPT)
- infrared absorption spectroscopy (IR)
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nfdi4chem-mol1234 (Unknown Molecule) Molecule
InChIKey ADGUCVKMBUJWJM-LSDHQDQOSA-N Molecular Formula C17H21FN6
Related Dataset(s)
- heteronuclear multiple bond coherence (HMBC)
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear single quantum coherence (HSQC)
- infrared absorption spectroscopy (IR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- fast-atom bombardment mass spectrometry (FABMS)
- distortionless enhancement with polarization transfer (DEPT)
- 19F nuclear magnetic resonance spectroscopy (19F NMR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
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nfdi4chem-mol1322 (Unknown Molecule) Molecule
InChIKey MVTMDTPYFXHKTK-UHFFFAOYSA-N Molecular Formula C56H46N6O4
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)
- infrared absorption spectroscopy (IR)
- 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)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- mass spectrometry (MS)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
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nfdi4chem-mol1470 (Unknown Molecule) Molecule
InChIKey OJEKMYNEGYNUPP-CZIZESTLSA-N Molecular Formula C16H22BrN5
Related Dataset(s)
- heteronuclear multiple bond coherence (HMBC)
- mass spectrometry (MS)
- distortionless enhancement with polarization transfer (DEPT)
- infrared absorption spectroscopy (IR)
- heteronuclear single quantum coherence (HSQC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- distortionless enhancement with polarization transfer (DEPT)
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nfdi4chem-mol1639 (Unknown Molecule) Molecule
InChIKey FEHNUWIZIPJQLZ-CZIZESTLSA-N Molecular Formula C17H25N5
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- elemental analysis (EA)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- mass spectrometry (MS)
- heteronuclear single quantum coherence (HSQC)
- infrared absorption spectroscopy (IR)
- heteronuclear multiple bond coherence (HMBC)
- distortionless enhancement with polarization transfer (DEPT)
- correlation spectroscopy (COSY)
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nfdi4chem-mol1982 (Unknown Molecule) Molecule
InChIKey NHXSMEATCRWYPK-ROJLCIKYSA-N Molecular Formula C32H26N2O5
Related Dataset(s)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- distortionless enhancement with polarization transfer (DEPT)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- atmospheric pressure chemical ionisation mass spectrometry (APCI MS)
- high-resolution mass spectrometry (HRMS)
- attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- single crystal X-ray diffraction (single-crystal X-ray diffraction)
- thin-layer chromatography (TLC)
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nfdi4chem-mol2162 (Unknown Molecule) Molecule
InChIKey GHGFCEMMULADQX-IFQUFVRCSA-N Molecular Formula C40H47N3
Related Dataset(s)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- heteronuclear multiple bond coherence (HMBC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- distortionless enhancement with polarization transfer (DEPT)
- infrared absorption spectroscopy (IR)
- heteronuclear single quantum coherence (HSQC)
- mass spectrometry (MS)
- correlation spectroscopy (COSY)
- distortionless enhancement with polarization transfer (DEPT)
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nfdi4chem-mol2194 (Unknown Molecule) Molecule
InChIKey BBXJSLXPCZXILR-CZIZESTLSA-N Molecular Formula C16H28N6O3
Related Dataset(s)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- infrared absorption spectroscopy (IR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
- fast-atom bombardment mass spectrometry (FABMS)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- distortionless enhancement with polarization transfer (DEPT)
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nfdi4chem-mol2338 (Unknown Molecule) Molecule
InChIKey CVZWWCQBQXVYQE-UHFFFAOYSA-N Molecular Formula C48H42N2O4
Related Dataset(s)
- correlation spectroscopy (COSY)
- heteronuclear single quantum coherence (HSQC)
- distortionless enhancement with polarization transfer (DEPT)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- heteronuclear multiple bond coherence (HMBC)
- distortionless enhancement with polarization transfer (DEPT)
- electrospray ionisation quadrupole detection (ESI Q Trap)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- infrared absorption spectroscopy (IR)
-
nfdi4chem-mol2345 (Unknown Molecule) Molecule
InChIKey IXNGYVJZOWPTAB-UHFFFAOYSA-N Molecular Formula C50H70Br4N2S5Si2
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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nfdi4chem-mol2374 (Unknown Molecule) Molecule
InChIKey IOAQHBXBXAUXJG-JQIJEIRASA-N Molecular Formula C12H20N6
Related Dataset(s)
- fast-atom bombardment mass spectrometry (FABMS)
- infrared absorption spectroscopy (IR)
- 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)
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nfdi4chem-mol2484 (Unknown Molecule) Molecule
InChIKey NPLQJBCPOSNZEZ-DNJOOXRZSA-N Molecular Formula C36H39N3
Related Dataset(s)
- 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)
- infrared absorption spectroscopy (IR)
- correlation spectroscopy (COSY)
- mass spectrometry (MS)
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear multiple bond coherence (HMBC)
-
nfdi4chem-mol2561 (Unknown Molecule) Molecule
InChIKey QPGWYAYYZXDARJ-UHFFFAOYSA-N Molecular Formula C25H30
Related Dataset(s)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear multiple bond coherence (HMBC)
- correlation spectroscopy (COSY)
- heteronuclear single quantum coherence (HSQC)
- infrared absorption spectroscopy (IR)
- distortionless enhancement with polarization transfer (DEPT)
- electrospray ionisation quadrupole detection (ESI Q Trap)
-
nfdi4chem-mol2838 (Unknown Molecule) Molecule
InChIKey OWJGFCXTEBEUEN-CZIZESTLSA-N Molecular Formula C16H19N7O2
Related Dataset(s)
- infrared absorption spectroscopy (IR)
- fast-atom bombardment mass spectrometry (FABMS)
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
-
nfdi4chem-mol2865 (Unknown Molecule) Molecule
InChIKey XUUMNWRCVWJMHB-LQKURTRISA-N Molecular Formula C24H21F3N2O2S
Related Dataset(s)
- correlation spectroscopy (COSY)
- heteronuclear single quantum coherence (HSQC)
- electrospray ionisation quadrupole detection (ESI Q Trap)
- 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)
- 19F nuclear magnetic resonance spectroscopy (19F NMR)
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nfdi4chem-mol2940 (Unknown Molecule) Molecule
InChIKey WSQPCVJPBSUDNZ-XTQSDGFTSA-N Molecular Formula C17H20F2N6
Related Dataset(s)
- electron ionisation mass spectrometry (EI-MS)
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 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)
- heteronuclear multiple bond coherence (HMBC)
- process
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- distortionless enhancement with polarization transfer (DEPT)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- mass spectrometry (MS)
- infrared absorption spectroscopy (IR)
- infrared absorption spectroscopy (IR)
- heteronuclear single quantum coherence (HSQC)
