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5-Isopropyl-2,3-bis(4-nitrobenzyloxy)tropone
SpectraBase Compound ID 3VaxZiPJCFP
InChI InChI=1S/C24H22N2O7/c1-16(2)19-7-12-22(27)24(33-15-18-5-10-21(11-6-18)26(30)31)23(13-19)32-14-17-3-8-20(9-4-17)25(28)29/h3-13,16H,14-15H2,1-2H3
InChIKey FDTVNKHYZFKYNE-UHFFFAOYSA-N
Mol Weight 450.45 g/mol
Molecular Formula C24H22N2O7
Exact Mass 450.142701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Hhvziug2pU
Name 5-Isopropyl-2,3-bis(4-nitrobenzyloxy)tropone
Alternate Name(s) 5-isopropyl-2,3-bis[(4-nitrobenzyl)oxy]-2,4,6-cycloheptatrien-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H22N2O7
InChI InChI=1S/C24H22N2O7/c1-16(2)19-7-12-22(27)24(33-15-18-5-10-21(11-6-18)26(30)31)23(13-19)32-14-17-3-8-20(9-4-17)25(28)29/h3-13,16H,14-15H2,1-2H3
InChIKey FDTVNKHYZFKYNE-UHFFFAOYSA-N
Molecular Weight 450.447 g/mol
SMILES C1(=C(C=C(C(C)C)C=CC1=O)OCc1ccc(N(=O)=O)cc1)OCc1ccc(N(=O)=O)cc1
SPLASH splash10-01ri-5903000000-cc56fb75be53d240e3e2
Source of Spectrum AJ-64-3310-20
Wiley ID 1387660