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Benzene, 1-(1-methyl-1-nitroethyl)-4-(2-methyl-1-propenyl)-2-nitro-
SpectraBase Compound ID 3XleL1mRKMA
InChI InChI=1S/C13H16N2O4/c1-9(2)7-10-5-6-11(12(8-10)14(16)17)13(3,4)15(18)19/h5-8H,1-4H3
InChIKey LDJKFAQHENITAL-UHFFFAOYSA-N
Mol Weight 264.28 g/mol
Molecular Formula C13H16N2O4
Exact Mass 264.111007 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lop7xW0nb7E
Name Benzene, 1-(1-methyl-1-nitroethyl)-4-(2-methyl-1-propenyl)-2-nitro-
Alternate Name(s) 1-(1-Methyl-1-nitroethyl)-4-(2-methyl-1-propenyl)-2-nitrobenzene 1-(1-Methyl-1-nitroethyl)-4-(2-methylprop-1-enyl)-2-nitrobenzene
CAS Registry Number 72949-61-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2O4
InChI InChI=1S/C13H16N2O4/c1-9(2)7-10-5-6-11(12(8-10)14(16)17)13(3,4)15(18)19/h5-8H,1-4H3
InChIKey LDJKFAQHENITAL-UHFFFAOYSA-N
Molecular Weight 264.281 g/mol
SMILES C(N(=O)=O)(c1c(N(=O)=O)cc(C=C(C)C)cc1)(C)C
SPLASH splash10-014i-9040000000-a2846d80c18d8d18d027
Source of Spectrum B-32-1959-0
Wiley ID 1267679