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3a,4-dihydro-1-oxo-4-methyl-2-benzylisoindoline

View entire compound with spectra: 1 MS (GC)

3a,4-dihydro-1-oxo-4-methyl-2-benzylisoindoline
SpectraBase Compound ID aaQQmyf2LC
InChI InChI=1S/C16H17NO/c1-12-6-5-9-14-15(12)11-17(16(14)18)10-13-7-3-2-4-8-13/h2-9,12,15H,10-11H2,1H3
InChIKey BLRDOYPXGCJWFS-UHFFFAOYSA-N
Mol Weight 239.32 g/mol
Molecular Formula C16H17NO
Exact Mass 239.131014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9LzgteMOkNH
Name 3a,4-dihydro-1-oxo-4-methyl-2-benzylisoindoline
Alternate Name(s) 2-Benzyl-4-methyl-2,3,3a,4-tetrahydro-1H-isoindol-1-one
CAS Registry Number 107733-70-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17NO
InChI InChI=1S/C16H17NO/c1-12-6-5-9-14-15(12)11-17(16(14)18)10-13-7-3-2-4-8-13/h2-9,12,15H,10-11H2,1H3
InChIKey BLRDOYPXGCJWFS-UHFFFAOYSA-N
Molecular Weight 239.318 g/mol
SMILES C1(N(CC2C(C=CC=C12)C)Cc1ccccc1)=O
SPLASH splash10-0006-9210000000-947f4ddabb5a6d0403d2
Source of Spectrum AJ-59-1359-5
Wiley ID 1242165