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Benzene, 1-(2-methyl-2-nitropropyl)-3-nitro-
SpectraBase Compound ID Disu4foneP6
InChI InChI=1S/C10H12N2O4/c1-10(2,12(15)16)7-8-4-3-5-9(6-8)11(13)14/h3-6H,7H2,1-2H3
InChIKey RQQWZUGHHIIZPQ-UHFFFAOYSA-N
Mol Weight 224.22 g/mol
Molecular Formula C10H12N2O4
Exact Mass 224.079707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Pc4X1zFSJM
Name Benzene, 1-(2-methyl-2-nitropropyl)-3-nitro-
Alternate Name(s) 1-(2-Methyl-2-nitropropyl)-3-nitrobenzene 2-Methyl-2-nitro-1-(m-nitrophenyl)propane
CAS Registry Number 86096-98-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12N2O4
InChI InChI=1S/C10H12N2O4/c1-10(2,12(15)16)7-8-4-3-5-9(6-8)11(13)14/h3-6H,7H2,1-2H3
InChIKey RQQWZUGHHIIZPQ-UHFFFAOYSA-N
Molecular Weight 224.216 g/mol
SMILES C(N(=O)=O)(Cc1cc(N(=O)=O)ccc1)(C)C
SPLASH splash10-004u-2900000000-94fe326b15cd0df2d070
Source of Spectrum B-36-93-0
Wiley ID 1224601