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Glycine, N-(2-methyl-1-oxo-2-butenyl)-, methyl ester, (E)-
SpectraBase Compound ID 1fhyqH9oNpH
InChI InChI=1S/C8H13NO3/c1-4-6(2)8(11)9-5-7(10)12-3/h4H,5H2,1-3H3,(H,9,11)/b6-4+
InChIKey IFMXGUOYXDBGDS-GQCTYLIASA-N
Mol Weight 171.2 g/mol
Molecular Formula C8H13NO3
Exact Mass 171.089543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IMBipIdSaLf
Name Glycine, N-(2-methyl-1-oxo-2-butenyl)-, methyl ester, (E)-
CAS Registry Number 55649-53-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13NO3
InChI InChI=1S/C8H13NO3/c1-4-6(2)8(11)9-5-7(10)12-3/h4H,5H2,1-3H3,(H,9,11)/b6-4+
InChIKey IFMXGUOYXDBGDS-GQCTYLIASA-N
Molecular Weight 171.196 g/mol
SMILES N(C(\C(=C\C)C)=O)CC(=O)OC
SPLASH splash10-053r-9200000000-74f7f5637cd7b0fd2261
Source of Spectrum JC-488-112-0
Synonyms Methyl ([(2E)-2-methyl-2-butenoyl]amino)acetate 2-[[(E)-2-methyl-1-oxobut-2-enyl]amino]acetic acid methyl ester 2-[[(E)-2-methylbut-2-enoyl]amino]acetic acid methyl ester Methyl 2-[[(E)-2-methylbut-2-enoyl]amino]acetate Methyl 2-[[(E)-2-methylbut-2-enoyl]amino]ethanoate N-Tiglylglycine methyl ester
Wiley ID 1167884