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2-cyano-2-(2,5-dimethylphenyl)acetic acid ethyl ester
SpectraBase Compound ID 8fWLVGXxFMh
InChI InChI=1S/C13H15NO2/c1-4-16-13(15)12(8-14)11-7-9(2)5-6-10(11)3/h5-7,12H,4H2,1-3H3
InChIKey YCWOLYIAMCREFN-UHFFFAOYSA-N
Mol Weight 217.27 g/mol
Molecular Formula C13H15NO2
Exact Mass 217.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FSPXk4D2Ick
Name 2-cyano-2-(2,5-dimethylphenyl)acetic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO2
InChI InChI=1S/C13H15NO2/c1-4-16-13(15)12(8-14)11-7-9(2)5-6-10(11)3/h5-7,12H,4H2,1-3H3
InChIKey YCWOLYIAMCREFN-UHFFFAOYSA-N
Molecular Weight 217.268 g/mol
SMILES C(c1c(ccc(c1)C)C)(C(=O)OCC)C#N
SPLASH splash10-00kf-0910000000-ae4d66ee6e861fae26ef
Source of Spectrum KC-1993-297-11
Synonyms Ethyl 2-cyano-2-(2,5-dimethylphenyl)acetate Ethyl 2-cyano-2-(2,5-dimethylphenyl)ethanoate
Wiley ID 778792