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(Z)-5-Methyl-2-{[4-(N-methylamino)-2-oxo-pent-3-en-3-yl]-methyl}-cyclohexa-2,5-dien-1,4-dione
SpectraBase Compound ID 7q7ETeiGUUR
InChI InChI=1S/C14H17NO3/c1-8-5-14(18)11(7-13(8)17)6-12(10(3)16)9(2)15-4/h5,7,15H,6H2,1-4H3/b12-9-
InChIKey VUPMBQTUQAHISQ-XFXZXTDPSA-N
Mol Weight 247.29 g/mol
Molecular Formula C14H17NO3
Exact Mass 247.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A9zSLlGTDWF
Name (Z)-5-Methyl-2-{[4-(N-methylamino)-2-oxo-pent-3-en-3-yl]-methyl}-cyclohexa-2,5-dien-1,4-dione
Alternate Name(s) (Z)-2-(2-acetyl-3-(methylamino)but-2-en-1-yl)-5-methylcyclohexa-2,5-diene-1,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17NO3
InChI InChI=1S/C14H17NO3/c1-8-5-14(18)11(7-13(8)17)6-12(10(3)16)9(2)15-4/h5,7,15H,6H2,1-4H3/b12-9-
InChIKey VUPMBQTUQAHISQ-XFXZXTDPSA-N
Literature Reference DOI 10.1002_(SICI)1521-3897(200001)342_1_17
Molecular Weight 247.294 g/mol
SMILES N(\C(=C\(CC=1C(=O)C=C(C)C(=O)C1)C(C)=O)C)C
SPLASH splash10-0a4l-9030000000-454ae58131dd43cedab5
Source of Spectrum JF-342-22-9b
Wiley ID 1766811