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N-(4-METHYLPHENYL)-7A-HYDROXY-3A,4,5,7A-TETRAHYDROISOINDOLIN-5-ONE

View entire compound with spectra: 1 NMR, and 1 MS (GC)

N-(4-METHYLPHENYL)-7A-HYDROXY-3A,4,5,7A-TETRAHYDROISOINDOLIN-5-ONE
SpectraBase Compound ID IQmPbGFkbXa
InChI InChI=1S/C15H17NO2/c1-11-2-4-13(5-3-11)16-9-12-8-14(17)6-7-15(12,18)10-16/h2-7,12,18H,8-10H2,1H3
InChIKey OCAXUEIDBKCFDK-UHFFFAOYSA-N
Mol Weight 243.31 g/mol
Molecular Formula C15H17NO2
Exact Mass 243.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID yKq2DdSXw
Name 2-(4-Methylphenyl)-7a-oxidanyl-1,3,3a,4-tetrahydroisoindol-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17NO2
InChI InChI=1S/C15H17NO2/c1-11-2-4-13(5-3-11)16-9-12-8-14(17)6-7-15(12,18)10-16/h2-7,12,18H,8-10H2,1H3
InChIKey OCAXUEIDBKCFDK-UHFFFAOYSA-N
Molecular Weight 243.306 g/mol
SMILES OC12CN(CC1CC(C=C2)=O)c1ccc(cc1)C
SPLASH splash10-000x-0960000000-1cad305d1ddfeac48097
Source of Spectrum Y-39-282-4
Synonyms 7a-hydroxy-2-(4-methylphenyl)-1,3,3a,4-tetrahydroisoindol-5-one 7a-hydroxy-2-(p-tolyl)-1,3,3a,4-tetrahydroisoindol-5-one
Wiley ID 1528423