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3-Cyanopropionic acid, ethyl ester

View entire compound with spectra: 4 MS (GC)

3-Cyanopropionic acid, ethyl ester
SpectraBase Compound ID 6fipGZLhMAZ
InChI InChI=1S/C6H9NO2/c1-2-9-6(8)4-3-5-7/h2-4H2,1H3
InChIKey BFSBTNGKMMFQNL-UHFFFAOYSA-N
Mol Weight 127.14 g/mol
Molecular Formula C6H9NO2
Exact Mass 127.063329 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3SBBMYkH0iF
Name 3-Cyanopropionic acid, ethyl ester
Alternate Name(s) Ethyl 3-cyanopropanoate 3-Cyanopropanoic acid ethyl ester Ethyl 3-cyanopropionate Propanoic acid, 3-cyano-, ethyl ester Propionic acid, 3-cyano-, ethyl ester
CAS Registry Number 10137-67-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H9NO2
InChI InChI=1S/C6H9NO2/c1-2-9-6(8)4-3-5-7/h2-4H2,1H3
InChIKey BFSBTNGKMMFQNL-UHFFFAOYSA-N
Molecular Weight 127.143 g/mol
SMILES C(=O)(CCC#N)OCC
SPLASH splash10-0fai-9100000000-558056a593f2f2abf44c
Wiley ID 1479851