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

*Links on SpectraBase are not permalinks.
3-Cyanomethyl-5-methoxyphthalide
SpectraBase Compound ID FwUCts7O3wC
InChI InChI=1S/C11H9NO3/c1-14-7-2-3-8-9(6-7)10(4-5-12)15-11(8)13/h2-3,6,10H,4H2,1H3
InChIKey RCISYHPOWCWIIT-UHFFFAOYSA-N
Mol Weight 203.2 g/mol
Molecular Formula C11H9NO3
Exact Mass 203.058243 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 8xG9LkxWXzs
Name 3-Cyanomethyl-5-methoxyphthalide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H9NO3
InChI InChI=1S/C11H9NO3/c1-14-7-2-3-8-9(6-7)10(4-5-12)15-11(8)13/h2-3,6,10H,4H2,1H3
InChIKey RCISYHPOWCWIIT-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol201563r
Molecular Weight 203.197 g/mol
SMILES c1cc(cc2C(OC(c12)=O)CC#N)OC
SPLASH splash10-03di-4920000000-a206b17ed2608f0f8777
Source of Spectrum A1-13-4153/SMS12-3kc
Synonyms 2-(6-Methoxy-3-oxo-1,3-dihydroisobenzofuran-1-yl)acetonitrile
Wiley ID 1753581