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3-Cyanopropionic acid, methyl ester
SpectraBase Compound ID 8fYpnmnswYE
InChI InChI=1S/C5H7NO2/c1-8-5(7)3-2-4-6/h2-3H2,1H3
InChIKey BPSKURPOKFSLHJ-UHFFFAOYSA-N
Mol Weight 113.12 g/mol
Molecular Formula C5H7NO2
Exact Mass 113.047678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8KYjK8GxjAV
Name Propanoic acid, 3-cyano-, methyl ester
CAS Registry Number 4107-62-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H7NO2
InChI InChI=1S/C5H7NO2/c1-8-5(7)3-2-4-6/h2-3H2,1H3
InChIKey BPSKURPOKFSLHJ-UHFFFAOYSA-N
Molecular Weight 113.116 g/mol
SMILES C(CCC(=O)OC)#N
SPLASH splash10-0ue9-9000000000-4647a7b965ad1dd96874
Source of Spectrum EP-2827-0-0
Synonyms 3-Cyanopropanoic acid methyl ester 3-Cyanopropionic acid methyl ester Methyl 3-cyanopropionate Methyl 3-cyanopropanoate Methyl .beta.-cyanopropionate Methyl cyanopropanoate Propionic acid, 3-cyano-, methyl ester 3-Cyanopropionic acid, methyl ester
Wiley ID 1123802