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5-Methyl-2-[5'-(N-methylamino)-2'-oxo-4'-hexenyl]-2,5-cyclohexadiene-1,4-dione
SpectraBase Compound ID Cf6OxwryWmy
InChI InChI=1S/C14H17NO3/c1-9-6-14(18)11(8-13(9)17)7-12(16)5-4-10(2)15-3/h4,6,8,15H,5,7H2,1-3H3/b10-4+
InChIKey PRMJCERZIDQCFZ-ONNFQVAWSA-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 BZrstqtqdNW
Name 5-Methyl-2-[5'-(N-methylamino)-2'-oxo-4'-hexenyl]-2,5-cyclohexadiene-1,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17NO3
InChI InChI=1S/C14H17NO3/c1-9-6-14(18)11(8-13(9)17)7-12(16)5-4-10(2)15-3/h4,6,8,15H,5,7H2,1-3H3/b10-4+
InChIKey PRMJCERZIDQCFZ-ONNFQVAWSA-N
Molecular Weight 247.294 g/mol
SMILES N(\C(=C\CC(CC1=CC(=O)C(=CC1=O)C)=O)C)C
SPLASH splash10-0002-9100000000-b5413110a75eeaa05292
Source of Spectrum D8-327-153-11
Synonyms 2-Methyl-5-[(4E)-5-(methylamino)-2-oxo-4-hexenyl]benzo-1,4-quinone
Wiley ID 1515151