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2,3,3a,4,5,6-hexahydro-2-benzyl-4,6-dimethyl-5-hydroxy-1H-isoindol-1-one
SpectraBase Compound ID DEZz95nIl9X
InChI InChI=1S/C17H21NO2/c1-11-8-14-15(12(2)16(11)19)10-18(17(14)20)9-13-6-4-3-5-7-13/h3-8,11-12,15-16,19H,9-10H2,1-2H3
InChIKey BWCLIZCWNBDYCD-UHFFFAOYSA-N
Mol Weight 271.36 g/mol
Molecular Formula C17H21NO2
Exact Mass 271.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KFb0cFhFaaK
Name 2,3,3a,4,5,6-hexahydro-2-benzyl-4,6-dimethyl-5-hydroxy-1H-isoindol-1-one
CAS Registry Number 114431-48-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21NO2
InChI InChI=1S/C17H21NO2/c1-11-8-14-15(12(2)16(11)19)10-18(17(14)20)9-13-6-4-3-5-7-13/h3-8,11-12,15-16,19H,9-10H2,1-2H3
InChIKey BWCLIZCWNBDYCD-UHFFFAOYSA-N
Molecular Weight 271.360 g/mol
SMILES OC1C(C=C2C(N(Cc3ccccc3)CC2C1C)=O)C
SPLASH splash10-022c-4090000000-482a8a8ff0ece542ad72
Source of Spectrum AJ-60-3266-15
Synonyms 2-Benzyl-5-hydroxy-4,6-dimethyl-2,3,3a,4,5,6-hexahydro-1H-isoindol-1-one
Wiley ID 1275440