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2-[(E)-3-(4-Nitrophenyl)acryloyl]-5-[1-(4-nitrophenyl)-meth-(E)-ylidene]-cyclopentanone
SpectraBase Compound ID BTIznvDlebl
InChI InChI=1S/C21H16N2O6/c24-20(12-5-14-1-7-17(8-2-14)22(26)27)19-11-6-16(21(19)25)13-15-3-9-18(10-4-15)23(28)29/h1-5,7-10,12-13,19H,6,11H2/b12-5+,16-13+
InChIKey GVFVDTUMLPLVTG-XPIBRZDCSA-N
Mol Weight 392.37 g/mol
Molecular Formula C21H16N2O6
Exact Mass 392.100836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KTOTYQwI2n5
Name 2-[(E)-3-(4-Nitrophenyl)acryloyl]-5-[1-(4-nitrophenyl)-meth-(E)-ylidene]-cyclopentanone
Appearance Reddish brown soild
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16N2O6
InChI InChI=1S/C21H16N2O6/c24-20(12-5-14-1-7-17(8-2-14)22(26)27)19-11-6-16(21(19)25)13-15-3-9-18(10-4-15)23(28)29/h1-5,7-10,12-13,19H,6,11H2/b12-5+,16-13+
InChIKey GVFVDTUMLPLVTG-XPIBRZDCSA-N
Instrument Name CEC 21-110B
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0007.d07
Molecular Weight 392.367 g/mol
Reported Formula C21H16N2O6
SMILES c1([N+](=O)[O-])ccc(cc1)\C=C\C(=O)C1C(\C(CC1)=C\c1ccc(cc1)[N+](=O)[O-])=O
SPLASH splash10-0a4i-4090000000-93007e7f7f02868dc416
Source of Spectrum ARK-2006-69-2h
Wiley ID 1871183