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1H-[1,2,3]Triazole-4-carboxylic acid, 1-(4-bromophenyl)-5-methyl-, ethyl ester
SpectraBase Compound ID QoAWCOiLkQ
InChI InChI=1S/C12H12BrN3O2/c1-3-18-12(17)11-8(2)16(15-14-11)10-6-4-9(13)5-7-10/h4-7H,3H2,1-2H3
InChIKey XINJEGKIOUNNCJ-UHFFFAOYSA-N
Mol Weight 310.15 g/mol
Molecular Formula C12H12BrN3O2
Exact Mass 309.01129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ok3Q8JC67o
Name 1H-[1,2,3]Triazole-4-carboxylic acid, 1-(4-bromophenyl)-5-methyl-, ethyl ester
Alternate Name(s) 1-(4-bromophenyl)-5-methyl-4-triazolecarboxylic acid ethyl ester 1-(4-bromophenyl)-5-methyl-triazole-4-carboxylic acid ethyl ester Ethyl 1-(4-bromophenyl)-5-methyl-1,2,3-triazole-4-carboxylate Ethyl 1-(4-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate Ethyl 1-(4-bromophenyl)-5-methyl-triazole-4-carboxylate
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Formula C12H12BrN3O2
InChI InChI=1S/C12H12BrN3O2/c1-3-18-12(17)11-8(2)16(15-14-11)10-6-4-9(13)5-7-10/h4-7H,3H2,1-2H3
InChIKey XINJEGKIOUNNCJ-UHFFFAOYSA-N
Molecular Weight 310.151 g/mol
SMILES c1(nn[n](c1C)-c1ccc(cc1)Br)C(=O)OCC
SPLASH splash10-0a6r-5940000000-1c2bc9fa830140bccca9
Wiley ID 1455839