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3,7,7-trimethyl-4-(4-methylphenyl)-2,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
SpectraBase Compound ID 6KaWzvIJ1e4
InChI InChI=1S/C20H23N3O/c1-11-5-7-13(8-6-11)17-16-12(2)22-23-19(16)21-14-9-20(3,4)10-15(24)18(14)17/h5-8,17H,9-10H2,1-4H3,(H2,21,22,23)
InChIKey GQFUYSHWMLTFPZ-UHFFFAOYSA-N
Mol Weight 321.42 g/mol
Molecular Formula C20H23N3O
Exact Mass 321.184112 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID SqQhZVDtZS
Name 3,7,7-trimethyl-4-(4-methylphenyl)-2,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Alternate Name(s) 3,7,7-trimethyl-4-(4-methylphenyl)-2,4,6,8-tetrahydro-1H-pyrazolo[3,4-b]quinolin-5-one 3,7,7-trimethyl-4-(p-tolyl)-2,4,6,8-tetrahydro-1H-pyrazolo[3,4-b]quinolin-5-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23N3O
InChI InChI=1S/C20H23N3O/c1-11-5-7-13(8-6-11)17-16-12(2)22-23-19(16)21-14-9-20(3,4)10-15(24)18(14)17/h5-8,17H,9-10H2,1-4H3,(H2,21,22,23)
InChIKey GQFUYSHWMLTFPZ-UHFFFAOYSA-N
Molecular Weight 321.424 g/mol
SMILES N1C=2CC(CC(C2C(c2c1n[nH]c2C)c1ccc(cc1)C)=O)(C)C
SPLASH splash10-0089-0097000000-60cc33a8dae410d20457
Source of Spectrum KC-57-6951-4
Wiley ID 1625316