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6-(Dibenzylamino)-3,4-dioxocylohexa-1,5-dienecarboxylic acid
SpectraBase Compound ID 8gVQrCjjBSt
InChI InChI=1S/C21H17NO4/c23-19-11-17(21(25)26)18(12-20(19)24)22(13-15-7-3-1-4-8-15)14-16-9-5-2-6-10-16/h1-12H,13-14H2,(H,25,26)
InChIKey ZDXZQZKHZZGHNG-UHFFFAOYSA-N
Mol Weight 347.37 g/mol
Molecular Formula C21H17NO4
Exact Mass 347.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 46jNbepCv1K
Name 6-(Dibenzylamino)-3,4-dioxocylohexa-1,5-dienecarboxylic acid
Appearance Red-orange crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H17NO4
InChI InChI=1S/C21H17NO4/c23-19-11-17(21(25)26)18(12-20(19)24)22(13-15-7-3-1-4-8-15)14-16-9-5-2-6-10-16/h1-12H,13-14H2,(H,25,26)
InChIKey ZDXZQZKHZZGHNG-UHFFFAOYSA-N
Instrument Name Shimadzu QP-1100EX
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0007.a16
Molecular Weight 347.370 g/mol
SMILES OC(C1=CC(C(C=C1N(Cc1ccccc1)Cc1ccccc1)=O)=O)=O
SPLASH splash10-0006-9021000000-07470bda4d04f7a8ec9c
Source of Spectrum ARK-2006-136-5b
Wiley ID 1871132