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1,2-Bisoctyloxy-4,5-dinitrobenzene
SpectraBase Compound ID 1tXXJuvDcGe
InChI InChI=1S/C22H36N2O6/c1-3-5-7-9-11-13-15-29-21-17-19(23(25)26)20(24(27)28)18-22(21)30-16-14-12-10-8-6-4-2/h17-18H,3-16H2,1-2H3
InChIKey NXMBFPCGRZCQNV-UHFFFAOYSA-N
Mol Weight 424.5 g/mol
Molecular Formula C22H36N2O6
Exact Mass 424.257337 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DECyOtcl6Hm
Name 1,2-Bisoctyloxy-4,5-dinitrobenzene
Alternate Name(s) 1,2-Dinitro-4,5-di(octyloxy)benzene 1,2-Dinitro-4,5-bis(octyloxy)benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H36N2O6
InChI InChI=1S/C22H36N2O6/c1-3-5-7-9-11-13-15-29-21-17-19(23(25)26)20(24(27)28)18-22(21)30-16-14-12-10-8-6-4-2/h17-18H,3-16H2,1-2H3
InChIKey NXMBFPCGRZCQNV-UHFFFAOYSA-N
Molecular Weight 424.538 g/mol
SMILES c1(c(cc(c(c1)N(=O)=O)N(=O)=O)OCCCCCCCC)OCCCCCCCC
SPLASH splash10-03e9-0910000000-1fa2c17207615a0c4e9d
Source of Spectrum F-69-3185-1
Wiley ID 1595024