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Methyl 2-(benzoylamido)-3-oxo-6-heptenoate

View entire compound with spectra: 1 MS (GC)

Methyl 2-(benzoylamido)-3-oxo-6-heptenoate
SpectraBase Compound ID IoqYeRVewrX
InChI InChI=1S/C15H17NO4/c1-3-4-10-12(17)13(15(19)20-2)16-14(18)11-8-6-5-7-9-11/h3,5-9,13H,1,4,10H2,2H3,(H,16,18)
InChIKey XBSPKGUSVQYUTP-UHFFFAOYSA-N
Mol Weight 275.3 g/mol
Molecular Formula C15H17NO4
Exact Mass 275.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KzF4i7qC3nJ
Name Methyl 2-(benzoylamido)-3-oxo-6-heptenoate
CAS Registry Number 77320-44-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17NO4
InChI InChI=1S/C15H17NO4/c1-3-4-10-12(17)13(15(19)20-2)16-14(18)11-8-6-5-7-9-11/h3,5-9,13H,1,4,10H2,2H3,(H,16,18)
InChIKey XBSPKGUSVQYUTP-UHFFFAOYSA-N
Molecular Weight 275.304 g/mol
SMILES N(C(C(=O)OC)C(=O)CCC=C)C(=O)c1ccccc1
SPLASH splash10-0a4i-6900000000-bfb2b60efd5a7e3edc34
Source of Spectrum J-46-2811-0
Wiley ID 1279062