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2,7-Bis(4-nitrobenzoyl)-4-isopropyltropone
SpectraBase Compound ID zuGRPuSFC2
InChI InChI=1S/C24H18N2O7/c1-14(2)17-7-12-20(22(27)15-3-8-18(9-4-15)25(30)31)24(29)21(13-17)23(28)16-5-10-19(11-6-16)26(32)33/h3-14H,1-2H3
InChIKey WKJRQUILKRNPOT-UHFFFAOYSA-N
Mol Weight 446.42 g/mol
Molecular Formula C24H18N2O7
Exact Mass 446.111401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID WqwKeB9mxs
Name 2,7-Bis(4-nitrobenzoyl)-4-isopropyltropone
Alternate Name(s) 4-isopropyl-2,7-bis(4-nitrobenzoyl)-2,4,6-cycloheptatrien-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H18N2O7
InChI InChI=1S/C24H18N2O7/c1-14(2)17-7-12-20(22(27)15-3-8-18(9-4-15)25(30)31)24(29)21(13-17)23(28)16-5-10-19(11-6-16)26(32)33/h3-14H,1-2H3
InChIKey WKJRQUILKRNPOT-UHFFFAOYSA-N
Molecular Weight 446.415 g/mol
SMILES C=1(C(C(=CC=C(C1)C(C)C)C(c1ccc(N(=O)=O)cc1)=O)=O)C(c1ccc(N(=O)=O)cc1)=O
SPLASH splash10-0f6t-2740900000-e0d09d9f3d5bddbcfbfc
Source of Spectrum AJ-64-3312-35
Wiley ID 1386582