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1,3-Benzenedicarboxylic acid, 5-(acetylamino)-2-amino-, dimethyl ester
SpectraBase Compound ID 4aDyawRSKqv
InChI InChI=1S/C12H14N2O5/c1-6(15)14-7-4-8(11(16)18-2)10(13)9(5-7)12(17)19-3/h4-5H,13H2,1-3H3,(H,14,15)
InChIKey IEMGOCLOHMFZAT-UHFFFAOYSA-N
Mol Weight 266.25 g/mol
Molecular Formula C12H14N2O5
Exact Mass 266.090272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9vorC5gVWuX
Name 1,3-Benzenedicarboxylic acid, 5-(acetylamino)-2-amino-, dimethyl ester
Alternate Name(s) Dimethyl 5-acetamido-2-aminoisophthalate Dimethyl 5-(acetylamino)-2-aminobenzene-1,3-dicarboxylate 5-Acetamido-2-aminobenzene-1,3-dicarboxylic acid dimethyl ester Dimethyl 5-acetamido-2-aminobenzene-1,3-dicarboxylate Dimethyl 5-acetamido-2-amino-benzene-1,3-dicarboxylate Dimethyl 5-acetamido-2-azanyl-benzene-1,3-dicarboxylate
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Formula C12H14N2O5
InChI InChI=1S/C12H14N2O5/c1-6(15)14-7-4-8(11(16)18-2)10(13)9(5-7)12(17)19-3/h4-5H,13H2,1-3H3,(H,14,15)
InChIKey IEMGOCLOHMFZAT-UHFFFAOYSA-N
Molecular Weight 266.253 g/mol
SMILES N(c1cc(c(c(c1)C(=O)OC)N)C(OC)=O)C(C)=O
SPLASH splash10-01bc-2790000000-03adb21fbfd603c75210
Source of Spectrum JX-2015-2-339
Wiley ID 1722075