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1H-1,2,3-Triazole-4,5-dicarboxylic acid, dimethyl ester
SpectraBase Compound ID 7HIUhKr3stp
InChI InChI=1S/C6H7N3O4/c1-12-5(10)3-4(6(11)13-2)8-9-7-3/h1-2H3,(H,7,8,9)
InChIKey HNGGSWPHMZXFNN-UHFFFAOYSA-N
Mol Weight 185.14 g/mol
Molecular Formula C6H7N3O4
Exact Mass 185.043656 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BDcuq3oIgSH
Name 1H-1,2,3-Triazole-4,5-dicarboxylic acid, dimethyl ester
Alternate Name(s) Dimethyl-1H-1,2,3-triazole-4,5-carboxylate Dimethyl 1H-1,2,3-triazole-4,5-dicarboxylate 2H-triazole-4,5-dicarboxylic acid dimethyl ester Dimethyl 2H-triazole-4,5-dicarboxylate Dimethyl 2H-1,2,3-triazole-4,5-dicarboxylate v-Triazole-4,5-dicarboxylic acid, dimethyl ester
CAS Registry Number 707-94-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H7N3O4
InChI InChI=1S/C6H7N3O4/c1-12-5(10)3-4(6(11)13-2)8-9-7-3/h1-2H3,(H,7,8,9)
InChIKey HNGGSWPHMZXFNN-UHFFFAOYSA-N
Molecular Weight 185.139 g/mol
SMILES [nH]1nnc(c1C(=O)OC)C(=O)OC
SPLASH splash10-0fdo-5900000000-8533c8b6948c7cce8e48
Source of Spectrum Y-46-132-6
Wiley ID 1666719