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2-Benzyl-4-methyl-3H-isoindol-1-one
SpectraBase Compound ID 4FB1s7dbeBV
InChI InChI=1S/C16H15NO/c1-12-6-5-9-14-15(12)11-17(16(14)18)10-13-7-3-2-4-8-13/h2-9H,10-11H2,1H3
InChIKey PLYTZKNWTWZNBT-UHFFFAOYSA-N
Mol Weight 237.3 g/mol
Molecular Formula C16H15NO
Exact Mass 237.115364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DFFtbWYxJ8p
Name 2-Benzyl-4-methyl-3H-isoindol-1-one
CAS Registry Number 107733-77-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15NO
InChI InChI=1S/C16H15NO/c1-12-6-5-9-14-15(12)11-17(16(14)18)10-13-7-3-2-4-8-13/h2-9H,10-11H2,1H3
InChIKey PLYTZKNWTWZNBT-UHFFFAOYSA-N
Molecular Weight 237.302 g/mol
SMILES C1(N(Cc2c(cccc12)C)Cc1ccccc1)=O
SPLASH splash10-000l-9460000000-8e1eaa4bd2ce3cbaf3f0
Source of Spectrum AJ-59-1361-14
Synonyms 2-Benzyl-4-methyl-isoindolin-1-one 4-Methyl-2-(phenylmethyl)-3H-isoindol-1-one
Wiley ID 1239801