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Acetic acid, cyano-, benzyl ester
SpectraBase Compound ID HvyJiaSoA9t
InChI InChI=1S/C10H9NO2/c11-7-6-10(12)13-8-9-4-2-1-3-5-9/h1-5H,6,8H2
InChIKey RCUIWQWWDLZNMS-UHFFFAOYSA-N
Mol Weight 175.19 g/mol
Molecular Formula C10H9NO2
Exact Mass 175.063329 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4GEsGmSueHD
Name Acetic acid, cyano-, benzyl ester
CAS Registry Number 14447-18-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9NO2
InChI InChI=1S/C10H9NO2/c11-7-6-10(12)13-8-9-4-2-1-3-5-9/h1-5H,6,8H2
InChIKey RCUIWQWWDLZNMS-UHFFFAOYSA-N
Molecular Weight 175.187 g/mol
SMILES c1ccc(cc1)COC(CC#N)=O
SPLASH splash10-014i-4900000000-595d5645fac9260bb370
Source of Spectrum IC-365-0-0
Synonyms Acetic acid, cyano-, phenylmethyl ester (phenylmethyl) 2-cyanoethanoate 2-cyanoacetic acid (phenylmethyl) ester 2-cyanoacetic acid benzyl ester Benzyl 2-cyanoacetate Benzyl cyanoacetate Benzyl ester of cyanoacetic acid
Wiley ID 1171407