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4'-Tert-butyl-2',6'-dimethyl-3',5'-dinitroacetophenone
SpectraBase Compound ID 6N04WD7YSf
InChI InChI=1S/C14H18N2O5/c1-7-10(9(3)17)8(2)13(16(20)21)11(14(4,5)6)12(7)15(18)19/h1-6H3
InChIKey WXCMHFPAUCOJIG-UHFFFAOYSA-N
Mol Weight 294.31 g/mol
Molecular Formula C14H18N2O5
Exact Mass 294.121572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G8TgzLNMrlP
Name ETHANONE, 1-[4-(1,1-DIMETHYLETHYL)-2,6-DIMETHYL-3,5-DINITROPHENYL]-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Exact Mass 294.121571683 u
Formula C14H18N2O5
InChI InChI=1S/C14H18N2O5/c1-7-10(9(3)17)8(2)13(16(20)21)11(14(4,5)6)12(7)15(18)19/h1-6H3
InChIKey WXCMHFPAUCOJIG-UHFFFAOYSA-N
Molecular Weight 294.307 g/mol
Nominal Mass 294 u
Number of Peaks 202
SMILES c1(c(C(C)=O)c(C)c(N(=O)=O)c(C(C)(C)C)c1N(=O)=O)C
SPLASH splash10-0006-9540000000-675ebe40587e5c0c0f86
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
Wiley ID MVX_001311