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1,3-Butanedione, 2,2-bis[(4-nitrophenyl)methyl]-1-phenyl-
SpectraBase Compound ID 6Bg56r0xatg
InChI InChI=1S/C24H20N2O6/c1-17(27)24(23(28)20-5-3-2-4-6-20,15-18-7-11-21(12-8-18)25(29)30)16-19-9-13-22(14-10-19)26(31)32/h2-14H,15-16H2,1H3
InChIKey VUBWUMILZVERJJ-UHFFFAOYSA-N
Mol Weight 432.43 g/mol
Molecular Formula C24H20N2O6
Exact Mass 432.132136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kcv6UJqMVtu
Name 1,3-Butanedione, 2,2-bis[(4-nitrophenyl)methyl]-1-phenyl-
CAS Registry Number 130745-78-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H20N2O6
InChI InChI=1S/C24H20N2O6/c1-17(27)24(23(28)20-5-3-2-4-6-20,15-18-7-11-21(12-8-18)25(29)30)16-19-9-13-22(14-10-19)26(31)32/h2-14H,15-16H2,1H3
InChIKey VUBWUMILZVERJJ-UHFFFAOYSA-N
Molecular Weight 432.432 g/mol
SMILES C(C(=O)c1ccccc1)(C(=O)C)(Cc1ccc(N(=O)=O)cc1)Cc1ccc(N(=O)=O)cc1
SPLASH splash10-0a4l-9600000000-c47401d51a33bf702253
Source of Spectrum F-46-5344-12
Synonyms 2,2-bis(4-nitrobenzyl)-1-phenyl-1,3-butanedione 2,2-bis(4-nitrobenzyl)-1-phenylbutane-1,3-dione
Wiley ID 1382270