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3,6-Dihydroxy-6-methyl-N,4-diphenyl-4,5,6,7-tetrahydro-1H-indazole-5-carboxamide
SpectraBase Compound ID AqbfyXnYlVX
InChI InChI=1S/C21H21N3O3/c1-21(27)12-15-17(19(25)24-23-15)16(13-8-4-2-5-9-13)18(21)20(26)22-14-10-6-3-7-11-14/h2-11,16,18,27H,12H2,1H3,(H,22,26)(H2,23,24,25)
InChIKey MFCMYLBYJQIUHC-UHFFFAOYSA-N
Mol Weight 363.42 g/mol
Molecular Formula C21H21N3O3
Exact Mass 363.158292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IoQm82QpC9g
Name 3,6-Dihydroxy-6-methyl-N,4-diphenyl-4,5,6,7-tetrahydro-1H-indazole-5-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21N3O3
InChI InChI=1S/C21H21N3O3/c1-21(27)12-15-17(19(25)24-23-15)16(13-8-4-2-5-9-13)18(21)20(26)22-14-10-6-3-7-11-14/h2-11,16,18,27H,12H2,1H3,(H,22,26)(H2,23,24,25)
InChIKey MFCMYLBYJQIUHC-UHFFFAOYSA-N
Molecular Weight 363.417 g/mol
SMILES [nH]1nc(c2c1CC(O)(C)C(C2c1ccccc1)C(Nc1ccccc1)=O)O
SPLASH splash10-004i-4691000000-9dfa5ba065de5778b24c
Source of Spectrum IY-2-5174-6
Synonyms 6-Hydroxy-6-methyl-3-oxo-N,4-diphenyl-2,4,5,7-tetrahydro-1H-indazole-5-carboxamide 6-Methyl-6-oxidanyl-3-oxidanylidene-N,4-diphenyl-2,4,5,7-tetrahydro-1H-indazole-5-carboxamide
Wiley ID 1659729