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(E)-4-amino-4-keto-but-2-enoic acid butyl ester
SpectraBase Compound ID LVMVQNDYMlY
InChI InChI=1S/C8H13NO3/c1-2-3-6-12-8(11)5-4-7(9)10/h4-5H,2-3,6H2,1H3,(H2,9,10)/b5-4+
InChIKey SCDOVRLBUIWLMF-SNAWJCMRSA-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 ZFY7D5oe2p
Name (E)-4-amino-4-keto-but-2-enoic acid butyl ester
CAS Registry Number 141805-69-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13NO3
InChI InChI=1S/C8H13NO3/c1-2-3-6-12-8(11)5-4-7(9)10/h4-5H,2-3,6H2,1H3,(H2,9,10)/b5-4+
InChIKey SCDOVRLBUIWLMF-SNAWJCMRSA-N
Molecular Weight 171.196 g/mol
SMILES NC(\C=C\C(=O)OCCCC)=O
SPLASH splash10-014j-7900000000-1429bea25db5577c0f17
Source of Spectrum U-1992-795-8
Synonyms (E)-4-amino-4-oxo-2-butenoic acid butyl ester Butyl (E)-4-amino-4-oxo-but-2-enoate Butyl (E)-4-azanyl-4-oxidanylidene-but-2-enoate
Wiley ID 764283