For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
4-Methyl-3-phenylisoquinolin-1(2H)-one
SpectraBase Compound ID FxXWpxxgmp
InChI InChI=1S/C16H13NO/c1-11-13-9-5-6-10-14(13)16(18)17-15(11)12-7-3-2-4-8-12/h2-10H,1H3,(H,17,18)
InChIKey VPMWFGDWNDOBSS-UHFFFAOYSA-N
Mol Weight 235.29 g/mol
Molecular Formula C16H13NO
Exact Mass 235.099714 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID KMdKR59mBU4
Name 4-Methyl-3-phenylisoquinolin-1(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13NO
InChI InChI=1S/C16H13NO/c1-11-13-9-5-6-10-14(13)16(18)17-15(11)12-7-3-2-4-8-12/h2-10H,1H3,(H,17,18)
InChIKey VPMWFGDWNDOBSS-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol202861k
Molecular Weight 235.286 g/mol
SMILES N1C(c2c(C(=C1c1ccccc1)C)cccc2)=O
SPLASH splash10-0019-0090000000-e4e091dc815724064d65
Source of Spectrum A1-13-6548/SMS11-3ad
Synonyms 4-Methyl-3-phenyl-2H-isoquinolin-1-one
Wiley ID 1754003