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XKORCTIIRYKLLG-ONEGZZNKSA-N
SpectraBase Compound ID FW6GH6wb3RI
InChI InChI=1S/C5H9NO2/c1-4(6)3-5(7)8-2/h3H,6H2,1-2H3/b4-3+
InChIKey XKORCTIIRYKLLG-ONEGZZNKSA-N
Mol Weight 115.13 g/mol
Molecular Formula C5H9NO2
Exact Mass 115.063329 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KJQLmIS8tjr
Name 2-Butenoic acid, 3-amino-, methyl ester
Alternate Name(s) Methyl (2E)-3-amino-2-butenoate (E)-3-amino-2-butenoic acid methyl ester (E)-3-aminobut-2-enoic acid methyl ester Crotonic acid, .beta.-amino-, methyl ester Methyl (E)-3-aminobut-2-enoate Methyl (E)-3-azanylbut-2-enoate Methyl 3-amino-2-butenoate Methyl 3-aminocrotonate Methyl-.beta.-aminocrotonate EINECS 238-056-5
CAS Registry Number 14205-39-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H9NO2
InChI InChI=1S/C5H9NO2/c1-4(6)3-5(7)8-2/h3H,6H2,1-2H3/b4-3+
InChIKey XKORCTIIRYKLLG-ONEGZZNKSA-N
Molecular Weight 115.132 g/mol
SMILES N\C(=C\C(OC)=O)C
SPLASH splash10-00lr-9200000000-b6dc4929d7f9fd4c406f
Source of Spectrum W5-2498-0-0
Wiley ID 1125011