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

*Links on SpectraBase are not permalinks.

3-(2,4-Dimethoxyphenyl)-3-oxopropanenitrile

View entire compound with spectra: 2 NMR, and 1 FTIR

3-(2,4-Dimethoxyphenyl)-3-oxopropanenitrile
SpectraBase Compound ID 6tgHtHC0zN9
InChI InChI=1S/C11H11NO3/c1-14-8-3-4-9(10(13)5-6-12)11(7-8)15-2/h3-4,7H,5H2,1-2H3
InChIKey ZLENRTUQTZZRDG-UHFFFAOYSA-N
Mol Weight 205.21 g/mol
Molecular Formula C11H11NO3
Exact Mass 205.073893 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 4hyc4UHeRxQ
Name 3-(2,4-Dimethoxyphenyl)-3-oxopropanenitrile
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 205.073893215 u
Formula C11H11NO3
InChI InChI=1S/C11H11NO3/c1-14-8-3-4-9(10(13)5-6-12)11(7-8)15-2/h3-4,7H,5H2,1-2H3
InChIKey ZLENRTUQTZZRDG-UHFFFAOYSA-N
Molecular Weight 205.213 g/mol
SMILES C1(=C(C=CC(=C1)OC)C(CC#N)=O)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.951028