CAS Registry Number 129488-73-9
Name:
Benzoic acid, 4-​(1-​cyano-​1-​methylethyl)​-​, methyl ester
4-Methoxycarbonyl-α,α-dimethylbenzeneacetonitrile
Methyl 4-(2-cyanopropan-2-yl)benzoate

Chemical Formula: C12H13NO2
Exact Mass: 203.09
Molecular Weight: 203.24
m/z: 203.09 (100.0%), 204.10 (13.2%), 205.10 (1.3%)

InChI: InChI=1S/C12H13NO2/c1-12(2,8-13)10-6-4-9(5-7-10)11(14)15-3/h4-7H,1-3H3
InChIKey: FIMMFBPABAIKED-UHFFFAOYSA-N
Canonical SMILES : CC(C)(C#N)C1=CC=C(C=C1)C(=O)OC

Specification

98%

(3) Von der Saal, Wolfgang; DE 3830054 A1 1990 CAPLUS