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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 4xKVZal2p6b
Name Acetic acid, cyano-, benzyl ester
Alternate Name(s) 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
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 splash10-054o-9500000000-928acfcca0cd6e3cd922
Source of Spectrum T-67-1584-0
Wiley ID 16872