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(Z)-Ethyl 4-oxo-4-(N-benzylisobutylamido)but-2-enoate
SpectraBase Compound ID I6I8JS1CGOQ
InChI InChI=1S/C17H21NO4/c1-4-22-16(20)11-10-15(19)18(17(21)13(2)3)12-14-8-6-5-7-9-14/h5-11,13H,4,12H2,1-3H3/b11-10-
InChIKey LZEJFJVZAKWXGE-KHPPLWFESA-N
Mol Weight 303.36 g/mol
Molecular Formula C17H21NO4
Exact Mass 303.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9rEvEYcYesQ
Name (Z)-Ethyl 4-oxo-4-(N-benzylisobutylamido)but-2-enoate
Comments Less than 3 mono-isotopic peaks
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Formula C17H21NO4
InChI InChI=1S/C17H21NO4/c1-4-22-16(20)11-10-15(19)18(17(21)13(2)3)12-14-8-6-5-7-9-14/h5-11,13H,4,12H2,1-3H3/b11-10-
InChIKey LZEJFJVZAKWXGE-KHPPLWFESA-N
Molecular Weight 303.358 g/mol
SMILES C(N(C(\C=C/C(=O)OCC)=O)Cc1ccccc1)(=O)C(C)C
SPLASH splash10-0a4i-0902000000-08209d202c031b9b58c5
Source of Spectrum F4-41-427-4b
Synonyms (Z)-4-[(2-methyl-1-oxopropyl)-(phenylmethyl)amino]-4-oxo-2-butenoic acid ethyl ester ethyl (Z)-4-[benzyl(2-methylpropanoyl)amino]-4-oxobut-2-enoate ethyl (Z)-4-[benzyl(2-methylpropanoyl)amino]-4-oxo-but-2-enoate ethyl (Z)-4-[2-methylpropanoyl-(phenylmethyl)amino]-4-oxidanylidene-but-2-enoate
Wiley ID 1671875