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1,2-dimethoxy-3-nitro-5-(2-nitroethyl)benzene
SpectraBase Compound ID KC7dMvGBxd0
InChI InChI=1S/C10H12N2O6/c1-17-9-6-7(3-4-11(13)14)5-8(12(15)16)10(9)18-2/h5-6H,3-4H2,1-2H3
InChIKey PFOSAUHZFZRACF-UHFFFAOYSA-N
Mol Weight 256.21 g/mol
Molecular Formula C10H12N2O6
Exact Mass 256.069536 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DGro8oZga0j
Name 1,2-dimethoxy-3-nitro-5-(2-nitroethyl)benzene
Alternate Name(s) 1-(3,4-Dimethoxy-5-nitrophenyl)-2-nitroethane
CAS Registry Number 114547-22-7
Comments Less than 3 mono-isotopic peaks
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Formula C10H12N2O6
InChI InChI=1S/C10H12N2O6/c1-17-9-6-7(3-4-11(13)14)5-8(12(15)16)10(9)18-2/h5-6H,3-4H2,1-2H3
InChIKey PFOSAUHZFZRACF-UHFFFAOYSA-N
Molecular Weight 256.214 g/mol
SMILES c1(N(=O)=O)c(c(OC)cc(c1)CCN(=O)=O)OC
SPLASH splash10-0a4i-0090000000-b686f9c2e01bd6aaa3a1
Source of Spectrum F-43-4807-4
Wiley ID 1259223