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

*Links on SpectraBase are not permalinks.
Benzeneacetonitrile, 4-acetyl-3,5-dimethoxy-.alpha.,.alpha.-dimethyl-
SpectraBase Compound ID ADZFB6UVinP
InChI InChI=1S/C14H17NO3/c1-9(16)13-11(17-4)6-10(7-12(13)18-5)14(2,3)8-15/h6-7H,1-5H3
InChIKey LXRDUJWMKCTTMR-UHFFFAOYSA-N
Mol Weight 247.29 g/mol
Molecular Formula C14H17NO3
Exact Mass 247.120843 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 JMASnLpdODS
Name Benzeneacetonitrile, 4-acetyl-3,5-dimethoxy-.alpha.,.alpha.-dimethyl-
Alternate Name(s) 2-(4-acetyl-3,5-dimethoxyphenyl)-2-methylpropanenitrile 2-(4-Acetyl-3,5-dimethoxyphenyl)-2-methylpropionitrile
CAS Registry Number 65048-78-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17NO3
InChI InChI=1S/C14H17NO3/c1-9(16)13-11(17-4)6-10(7-12(13)18-5)14(2,3)8-15/h6-7H,1-5H3
InChIKey LXRDUJWMKCTTMR-UHFFFAOYSA-N
Molecular Weight 247.294 g/mol
SMILES c1(c(cc(cc1OC)C(C#N)(C)C)OC)C(=O)C
SPLASH splash10-001i-1190000000-62964f15b258d04eadda
Source of Spectrum I-55-788-0
Wiley ID 1250013