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Benzenepropanal, 2-nitro-.alpha.-(4-nitrophenyl)-.beta.-oxo-
SpectraBase Compound ID 6W2r1FzzSS9
InChI InChI=1S/C15H10N2O6/c18-9-13(10-5-7-11(8-6-10)16(20)21)15(19)12-3-1-2-4-14(12)17(22)23/h1-9,13H
InChIKey QUROLTKVXRCQMH-UHFFFAOYSA-N
Mol Weight 314.25 g/mol
Molecular Formula C15H10N2O6
Exact Mass 314.053886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2RgiiysJPz2
Name Benzenepropanal, 2-nitro-.alpha.-(4-nitrophenyl)-.beta.-oxo-
Alternate Name(s) 2-(4-Nitrophenyl)-3-(2-nitrophenyl)-3-oxo-1-propanal 3-(2-nitrophenyl)-2-(4-nitrophenyl)-3-oxopropanal
CAS Registry Number 81883-97-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H10N2O6
InChI InChI=1S/C15H10N2O6/c18-9-13(10-5-7-11(8-6-10)16(20)21)15(19)12-3-1-2-4-14(12)17(22)23/h1-9,13H
InChIKey QUROLTKVXRCQMH-UHFFFAOYSA-N
Molecular Weight 314.253 g/mol
SMILES c1(N(=O)=O)c(C(C(c2ccc(N(=O)=O)cc2)C=O)=O)cccc1
SPLASH splash10-0udi-0910000000-8a1a2d9b9414742e5098
Source of Spectrum O-19-483-8
Wiley ID 1314777