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Ethyl 6-hydroxy-6-methyl-4-(3-nitrophenyl)-3-oxo-3,3a,4,5,6,7-hexahydro-2H-indazole-5-carboxylate
SpectraBase Compound ID 6wpqQchWdbp
InChI InChI=1S/C17H19N3O6/c1-3-26-16(22)14-12(9-5-4-6-10(7-9)20(24)25)13-11(8-17(14,2)23)18-19-15(13)21/h4-7,12-14,23H,3,8H2,1-2H3,(H,19,21)
InChIKey PGLOJNOMLZJZLP-UHFFFAOYSA-N
Mol Weight 361.35 g/mol
Molecular Formula C17H19N3O6
Exact Mass 361.127385 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FrshPIrGDX7
Name Ethyl 6-hydroxy-6-methyl-4-(3-nitrophenyl)-3-oxo-3,3a,4,5,6,7-hexahydro-2H-indazole-5-carboxylate
CAS Registry Number 318466-51-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19N3O6
InChI InChI=1S/C17H19N3O6/c1-3-26-16(22)14-12(9-5-4-6-10(7-9)20(24)25)13-11(8-17(14,2)23)18-19-15(13)21/h4-7,12-14,23H,3,8H2,1-2H3,(H,19,21)
InChIKey PGLOJNOMLZJZLP-UHFFFAOYSA-N
Molecular Weight 361.354 g/mol
SMILES N1N=C2CC(C(C(C2C1=O)c1cc(N(=O)=O)ccc1)C(=O)OCC)(O)C
SPLASH splash10-00di-8890000000-c01cf45a4f900c04b178
Source of Spectrum AD-0-2532-0
Synonyms 6-Hydroxy-3-keto-6-methyl-4-(3-nitrophenyl)-3a,4,5,7-tetrahydro-2H-indazole-5-carboxylic acid ethyl ester 6-Hydroxy-6-methyl-4-(3-nitrophenyl)-3-oxo-3a,4,5,7-tetrahydro-2H-indazole-5-carboxylic acid ethyl ester Benzopyrazole-5-carboxylic acid, 2,3,4,5,6,7-hexahydro-6-hydroxy-6-methyl-4-(3-nitrophenyl)-3-oxo-, ethyl ester Ethyl 6-hydroxy-6-methyl-4-(3-nitrophenyl)-3-oxo-3a,4,5,7-tetrahydro-2H-indazole-5-carboxylate Ethyl 6-methyl-4-(3-nitrophenyl)-6-oxidanyl-3-oxidanylidene-3a,4,5,7-tetrahydro-2H-indazole-5-carboxylate
Wiley ID 1431396