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

*Links on SpectraBase are not permalinks.
2-Butenedioic acid, 2-cyano-, dimethyl ester, (Z)-
SpectraBase Compound ID 4oiDQzy9bEW
InChI InChI=1S/C7H7NO4/c1-11-6(9)3-5(4-8)7(10)12-2/h3H,1-2H3/b5-3-
InChIKey FODBHLMSMZRICS-HYXAFXHYSA-N
Mol Weight 169.14 g/mol
Molecular Formula C7H7NO4
Exact Mass 169.037508 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 GGVfmcBcZbs
Name 2-Butenedioic acid, 2-cyano-, dimethyl ester, (Z)-
CAS Registry Number 54797-30-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H7NO4
InChI InChI=1S/C7H7NO4/c1-11-6(9)3-5(4-8)7(10)12-2/h3H,1-2H3/b5-3-
InChIKey FODBHLMSMZRICS-HYXAFXHYSA-N
Molecular Weight 169.136 g/mol
SMILES C(\C=C/(C(=O)OC)C#N)(=O)OC
SPLASH splash10-000i-3900000000-6ba2b9eae41bd8bf4a2b
Source of Spectrum B-36-1980-0
Synonyms (Z)-2-cyano-2-butenedioic acid dimethyl ester Dimethyl (Z)-2-cyanobut-2-enedioate
Wiley ID 1165627