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1,3-Benzenedicarboxylic acid, 5-amino-2-nitro-, dimethyl ester
SpectraBase Compound ID C0AcBB62kVY
InChI InChI=1S/C10H10N2O6/c1-17-9(13)6-3-5(11)4-7(10(14)18-2)8(6)12(15)16/h3-4H,11H2,1-2H3
InChIKey ZPPMGJYJAAIIDF-UHFFFAOYSA-N
Mol Weight 254.2 g/mol
Molecular Formula C10H10N2O6
Exact Mass 254.053886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 71fMIxo1Ndj
Name 1,3-Benzenedicarboxylic acid, 5-amino-2-nitro-, dimethyl ester
Alternate Name(s) Dimethyl 5-amino-2-nitroisophthalate Dimethyl 5-amino-2-nitrobenzene-1,3-dicarboxylate 5-Amino-2-nitrobenzene-1,3-dicarboxylic acid dimethyl ester Dimethyl 5-amino-2-nitro-benzene-1,3-dicarboxylate Dimethyl 5-azanyl-2-nitro-benzene-1,3-dicarboxylate
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Formula C10H10N2O6
InChI InChI=1S/C10H10N2O6/c1-17-9(13)6-3-5(11)4-7(10(14)18-2)8(6)12(15)16/h3-4H,11H2,1-2H3
InChIKey ZPPMGJYJAAIIDF-UHFFFAOYSA-N
Molecular Weight 254.198 g/mol
SMILES Nc1cc(C(OC)=O)c(c(c1)C(=O)OC)[N+]([O-])=O
SPLASH splash10-0h90-9650000000-fe570cd2f4341716fd5d
Source of Spectrum JX-2015-1-808
Wiley ID 1721590