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4-(sec-butylamino)-4-oxo-2-(2-oxo-2-propoxyethyl)but-2-enoic acid
SpectraBase Compound ID 5EIqKQVKEMg
InChI InChI=1S/C13H21NO5/c1-4-6-19-12(16)8-10(13(17)18)7-11(15)14-9(3)5-2/h7,9H,4-6,8H2,1-3H3,(H,14,15)(H,17,18)
InChIKey UXMLYMGKZXBMAI-UHFFFAOYSA-N
Mol Weight 271.31 g/mol
Molecular Formula C13H21NO5
Exact Mass 271.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ba6UTwgqG4L
Name 4-(sec-butylamino)-4-oxo-2-(2-oxo-2-propoxyethyl)but-2-enoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H21NO5
InChI InChI=1S/C13H21NO5/c1-4-6-19-12(16)8-10(13(17)18)7-11(15)14-9(3)5-2/h7,9H,4-6,8H2,1-3H3,(H,14,15)(H,17,18)
InChIKey UXMLYMGKZXBMAI-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 271.313 g/mol
SMILES OC(C(=CC(=O)NC(C)CC)CC(=O)OCCC)=O
SPLASH splash10-08gi-4960000000-1306c7e10d203030485f
Source of Spectrum WO2010101477A1
Wiley ID 1844237