-
methyl 1-(1H-pyrazol-5-yl)triazole-4-carboxylate Molecule
InChIKey PWKBPRHBEDYORH-UHFFFAOYSA-N Molecular Formula C7H7N5O2
Related Dataset(s)
- heteronuclear multiple bond coherence (HMBC)
- infrared absorption spectroscopy (IR)
- distortionless enhancement with polarization transfer (DEPT)
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- mass spectrometry (MS)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- heteronuclear single quantum coherence (HSQC)
-
methyl 1-(5-methyl-1H-pyrazol-3-yl)triazole-4-carboxylate Molecule
InChIKey AXYCMAQNQSYSIG-UHFFFAOYSA-N Molecular Formula C8H9N5O2
Related Dataset(s)
- heteronuclear multiple bond coherence (HMBC)
- heteronuclear single quantum coherence (HSQC)
- mass spectrometry (MS)
- distortionless enhancement with polarization transfer (DEPT)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
- infrared absorption spectroscopy (IR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
-
methyl 1-[1-[(4-bromophenyl)methyl]pyrazol-3-yl]triazole-4-carboxylate Molecule
InChIKey CNHRLRYEDLASIW-UHFFFAOYSA-N Molecular Formula C14H12BrN5O2
Related Dataset(s)
- heteronuclear single quantum coherence (HSQC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- infrared absorption spectroscopy (IR)
- heteronuclear multiple bond coherence (HMBC)
- mass spectrometry (MS)
- distortionless enhancement with polarization transfer (DEPT)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
-
methyl 1-[4-cyano-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]triazole-4-carboxylate Molecule
InChIKey UUNQVGVZWMJXOZ-UHFFFAOYSA-N Molecular Formula C15H11FN6O2
Related Dataset(s)
- infrared absorption spectroscopy (IR)
- mass spectrometry (MS)
- distortionless enhancement with polarization transfer (DEPT)
- distortionless enhancement with polarization transfer (DEPT)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 19F nuclear magnetic resonance spectroscopy (19F NMR)
- heteronuclear single quantum coherence (HSQC)
- heteronuclear multiple bond coherence (HMBC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
-
methyl 3-bromoquinoline-6-carboxylate Molecule
InChIKey IQKJYNVCQVDCOU-UHFFFAOYSA-N Molecular Formula C11H8BrNO2
Related Dataset(s)
- correlation spectroscopy (COSY)
- distortionless enhancement with polarization transfer (DEPT)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- heteronuclear multiple bond coherence (HMBC)
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- heteronuclear single quantum coherence (HSQC)
-
methyl 4-[1-(4-cyano-1H-pyrazol-5-yl)triazol-4-yl]benzoate Molecule
InChIKey FXIYGLHLKLOXQB-UHFFFAOYSA-N Molecular Formula C14H10N6O2
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- infrared absorption spectroscopy (IR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- heteronuclear multiple bond coherence (HMBC)
- heteronuclear single quantum coherence (HSQC)
- mass spectrometry (MS)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
-
methyl 4-[1-[4-cyano-1-[(4-methylphenyl)methyl]pyrazol-3-yl]triazol-4-yl]benz... Molecule
InChIKey DMRAVMAMSLYEBQ-UHFFFAOYSA-N Molecular Formula C22H18N6O2
Related Dataset(s)
- heteronuclear multiple bond coherence (HMBC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
- mass spectrometry (MS)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- infrared absorption spectroscopy (IR)
- heteronuclear single quantum coherence (HSQC)
- distortionless enhancement with polarization transfer (DEPT)
-
methyl 4-[[4-cyano-5-[(E)-[di(propan-2-yl)amino]diazenyl]pyrazol-1-yl]methyl]... Molecule
InChIKey HQEHAWORIRDNAT-GHVJWSGMSA-N Molecular Formula C19H24N6O2
Related Dataset(s)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear single quantum coherence (HSQC)
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear multiple bond coherence (HMBC)
- mass spectrometry (MS)
- infrared absorption spectroscopy (IR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
-
methyl 4-amino-2,5-difluorobenzoate Molecule
InChIKey WFHMJOPCOWABHH-UHFFFAOYSA-N Molecular Formula C8H7F2NO2
Related Dataset(s)
- correlation spectroscopy (COSY)
- heteronuclear multiple bond coherence (HMBC)
- 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)
- distortionless enhancement with polarization transfer (DEPT)
- 19F nuclear magnetic resonance spectroscopy (19F NMR)
-
nfdi4chem-mol1081 (Unknown Molecule) Molecule
InChIKey PWDVDRMYMFXQOH-UHFFFAOYSA-N Molecular Formula C21H22
Related Dataset(s)
- heteronuclear multiple bond coherence (HMBC)
- correlation spectroscopy (COSY)
- distortionless enhancement with polarization transfer (DEPT)
- electrospray ionisation quadrupole detection (ESI Q Trap)
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear single quantum coherence (HSQC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- infrared absorption spectroscopy (IR)
-
nfdi4chem-mol1234 (Unknown Molecule) Molecule
InChIKey ADGUCVKMBUJWJM-LSDHQDQOSA-N Molecular Formula C17H21FN6
Related Dataset(s)
- infrared absorption spectroscopy (IR)
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear multiple bond coherence (HMBC)
- fast-atom bombardment mass spectrometry (FABMS)
- 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)
- heteronuclear single quantum coherence (HSQC)
-
nfdi4chem-mol1470 (Unknown Molecule) Molecule
InChIKey OJEKMYNEGYNUPP-CZIZESTLSA-N Molecular Formula C16H22BrN5
Related Dataset(s)
- mass spectrometry (MS)
- heteronuclear single quantum coherence (HSQC)
- distortionless enhancement with polarization transfer (DEPT)
- distortionless enhancement with polarization transfer (DEPT)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- heteronuclear multiple bond coherence (HMBC)
- infrared absorption spectroscopy (IR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
-
nfdi4chem-mol1639 (Unknown Molecule) Molecule
InChIKey FEHNUWIZIPJQLZ-CZIZESTLSA-N Molecular Formula C17H25N5
Related Dataset(s)
- heteronuclear multiple bond coherence (HMBC)
- distortionless enhancement with polarization transfer (DEPT)
- 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)
- elemental analysis (EA)
- correlation spectroscopy (COSY)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
-
nfdi4chem-mol2162 (Unknown Molecule) Molecule
InChIKey GHGFCEMMULADQX-IFQUFVRCSA-N Molecular Formula C40H47N3
Related Dataset(s)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- infrared absorption spectroscopy (IR)
- 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)
- correlation spectroscopy (COSY)
- mass spectrometry (MS)
-
nfdi4chem-mol2338 (Unknown Molecule) Molecule
InChIKey CVZWWCQBQXVYQE-UHFFFAOYSA-N Molecular Formula C48H42N2O4
Related Dataset(s)
- infrared absorption spectroscopy (IR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- heteronuclear single quantum coherence (HSQC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- electrospray ionisation quadrupole detection (ESI Q Trap)
- correlation spectroscopy (COSY)
- heteronuclear multiple bond coherence (HMBC)
- distortionless enhancement with polarization transfer (DEPT)
- distortionless enhancement with polarization transfer (DEPT)
-
nfdi4chem-mol2484 (Unknown Molecule) Molecule
InChIKey NPLQJBCPOSNZEZ-DNJOOXRZSA-N Molecular Formula C36H39N3
Related Dataset(s)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- infrared absorption spectroscopy (IR)
- correlation spectroscopy (COSY)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- mass spectrometry (MS)
- heteronuclear single quantum coherence (HSQC)
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear multiple bond coherence (HMBC)
- distortionless enhancement with polarization transfer (DEPT)
-
nfdi4chem-mol2561 (Unknown Molecule) Molecule
InChIKey QPGWYAYYZXDARJ-UHFFFAOYSA-N Molecular Formula C25H30
Related Dataset(s)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
- infrared absorption spectroscopy (IR)
- electrospray ionisation quadrupole detection (ESI Q Trap)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- correlation spectroscopy (COSY)
- heteronuclear multiple bond coherence (HMBC)
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear single quantum coherence (HSQC)
-
nfdi4chem-mol2940 (Unknown Molecule) Molecule
InChIKey WSQPCVJPBSUDNZ-XTQSDGFTSA-N Molecular Formula C17H20F2N6
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 19F nuclear magnetic resonance spectroscopy (19F NMR)
- heteronuclear single quantum coherence (HSQC)
- electron ionisation mass spectrometry (EI-MS)
- heteronuclear multiple bond coherence (HMBC)
- distortionless enhancement with polarization transfer (DEPT)
- infrared absorption spectroscopy (IR)
- process
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- infrared absorption spectroscopy (IR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
- mass spectrometry (MS)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- distortionless enhancement with polarization transfer (DEPT)
-
nfdi4chem-mol3112 (Unknown Molecule) Molecule
InChIKey YBXSRUSOAMLUNL-ZMVQRVHOSA-N Molecular Formula C52H46N4O8
Related Dataset(s)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- ultraviolet-visible spectrophotometry (UV-VIS)
- infrared absorption spectroscopy (IR)
- distortionless enhancement with polarization transfer (DEPT)
- mass spectrometry (MS)
- heteronuclear single quantum coherence (HSQC)
- correlation spectroscopy (COSY)
- heteronuclear multiple bond coherence (HMBC)
- distortionless enhancement with polarization transfer (DEPT)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
-
nfdi4chem-mol3146 (Unknown Molecule) Molecule
InChIKey FZUUXBMFWLBSAE-XTQSDGFTSA-N Molecular Formula C19H24N6O2
Related Dataset(s)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- infrared absorption spectroscopy (IR)
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- heteronuclear single quantum coherence (HSQC)
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear multiple bond coherence (HMBC)
- mass spectrometry (MS)
