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Glycolic acid, cyano-, ethyl ester, benzoate (ester)
SpectraBase Compound ID EvdFfHnXtfM
InChI InChI=1S/C12H11NO4/c1-2-16-12(15)10(8-13)17-11(14)9-6-4-3-5-7-9/h3-7,10H,2H2,1H3
InChIKey PMUPRIZMXFGFCO-UHFFFAOYSA-N
Mol Weight 233.22 g/mol
Molecular Formula C12H11NO4
Exact Mass 233.068808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6rSWX5VmqeE
Name Glycolic acid, cyano-, ethyl ester, benzoate (ester)
Alternate Name(s) 1-Cyano-2-ethoxy-2-oxoethyl benzoate (1-cyano-2-ethoxy-2-oxidanylidene-ethyl) benzoate benzoic acid (1-cyano-2-ethoxy-2-keto-ethyl) ester benzoic acid (1-cyano-2-ethoxy-2-oxoethyl) ester (1-cyano-2-ethoxy-2-oxoethyl) benzoate
CAS Registry Number 19788-59-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11NO4
InChI InChI=1S/C12H11NO4/c1-2-16-12(15)10(8-13)17-11(14)9-6-4-3-5-7-9/h3-7,10H,2H2,1H3
InChIKey PMUPRIZMXFGFCO-UHFFFAOYSA-N
Molecular Weight 233.223 g/mol
SMILES CCOC(C(C#N)OC(c1ccccc1)=O)=O
SPLASH splash10-0a4i-5900000000-6c3640cab4854cb4555e
Source of Spectrum T-68-2440-0
Wiley ID 31450