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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 B0WzcckvwBM
Name 4'-Tert-butyl-2',6'-dimethyl-3',5'-dinitroacetophenone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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
Ionization Type EI-B
Molecular Weight 294.307 g/mol
SMILES CC(=O)c1c(C)c(c(c(c1C)[N+]([O-])=O)C(C)(C)C)[N+]([O-])=O
SPLASH splash10-004i-1390000000-90782ab8b90e55eada77
Source of Spectrum SRH-2022-10421-0
Wiley ID 1832038