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5-Methyl-2-[4'-(N-benzylamino)-2'-oxo-3'-pentenyl]-2,5-cyclohexadiene-1,4-dione
SpectraBase Compound ID BKIx2TJarqy
InChI InChI=1S/C19H19NO3/c1-13-8-19(23)16(11-18(13)22)10-17(21)9-14(2)20-12-15-6-4-3-5-7-15/h3-9,11,20H,10,12H2,1-2H3/b14-9+
InChIKey ZAXDXCSFNQMJMF-NTEUORMPSA-N
Mol Weight 309.37 g/mol
Molecular Formula C19H19NO3
Exact Mass 309.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IsQvEfQzV5r
Name 5-Methyl-2-[4'-(N-benzylamino)-2'-oxo-3'-pentenyl]-2,5-cyclohexadiene-1,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H19NO3
InChI InChI=1S/C19H19NO3/c1-13-8-19(23)16(11-18(13)22)10-17(21)9-14(2)20-12-15-6-4-3-5-7-15/h3-9,11,20H,10,12H2,1-2H3/b14-9+
InChIKey ZAXDXCSFNQMJMF-NTEUORMPSA-N
Molecular Weight 309.365 g/mol
SMILES N(\C(=C\C(CC1=CC(=O)C(=CC1=O)C)=O)C)Cc1ccccc1
SPLASH splash10-0006-9300000000-1b2a6e1608533fdb9f03
Source of Spectrum D8-327-152-10
Synonyms 2-[(3E)-4-(benzylamino)-2-oxo-3-pentenyl]-5-methylbenzo-1,4-quinone
Wiley ID 1515153