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1-[6-hydroxy-3,6-dimethyl-4-(3-nitrophenyl)-4,5,6,7-tetrahydro-2H-indazol-5-yl]ethanone
SpectraBase Compound ID 5VgOfhgqr57
InChI InChI=1S/C17H19N3O4/c1-9-14-13(19-18-9)8-17(3,22)16(10(2)21)15(14)11-5-4-6-12(7-11)20(23)24/h4-7,15-16,22H,8H2,1-3H3,(H,18,19)
InChIKey WQMILBNFFUVBET-UHFFFAOYSA-N
Mol Weight 329.36 g/mol
Molecular Formula C17H19N3O4
Exact Mass 329.137556 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ioZLYwwrQf
Name 1-[6-Hydroxy-3,6-dimethyl-4-(3-nitrophenyl)-4,5,6,7-tetrahydro-2H-indazol-5-yl]ethanone
CAS Registry Number 171199-38-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19N3O4
InChI InChI=1S/C17H19N3O4/c1-9-14-13(19-18-9)8-17(3,22)16(10(2)21)15(14)11-5-4-6-12(7-11)20(23)24/h4-7,15-16,22H,8H2,1-3H3,(H,18,19)
InChIKey WQMILBNFFUVBET-UHFFFAOYSA-N
Molecular Weight 329.356 g/mol
SMILES [nH]1nc2c(C(C(C(C2)(O)C)C(=O)C)c2cc(N(=O)=O)ccc2)c1C
SPLASH splash10-014l-6590000000-94a30e9cd32df3ae1932
Source of Spectrum AD-0-2532-0
Synonyms 1-[3,6-dimethyl-4-(3-nitrophenyl)-6-oxidanyl-2,4,5,7-tetrahydroindazol-5-yl]ethanone 1-[6-hydroxy-3,6-dimethyl-4-(3-nitrophenyl)-2,4,5,7-tetrahydroindazol-5-yl]ethanone Benzo[c]pyrazole, 4,5,6,7-tetrahydro-5-acetyl-6-hydroxy-3,6-dimethyl-4-(3-nitrophenyl)-
Wiley ID 1429990