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1-Carbethoxy-5-methyl-3-phenyl-1,2,4-triazole
SpectraBase Compound ID Ci2qG9rzPTc
InChI InChI=1S/C12H13N3O2/c1-3-17-12(16)15-9(2)13-11(14-15)10-7-5-4-6-8-10/h4-8H,3H2,1-2H3
InChIKey JKYAXYFGRBERBD-UHFFFAOYSA-N
Mol Weight 231.25 g/mol
Molecular Formula C12H13N3O2
Exact Mass 231.100777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 98UUJjlCu1y
Name 1-Carbethoxy-5-methyl-3-phenyl-1,2,4-triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13N3O2
InChI InChI=1S/C12H13N3O2/c1-3-17-12(16)15-9(2)13-11(14-15)10-7-5-4-6-8-10/h4-8H,3H2,1-2H3
InChIKey JKYAXYFGRBERBD-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.19740570514
Molecular Weight 231.255 g/mol
SMILES c1(n[n](c(n1)C)C(=O)OCC)-c1ccccc1
SPLASH splash10-0api-1920000000-11f514ccf22a9f4c5f69
Source of Spectrum H-57-1390-8c
Synonyms Ethyl 5-methyl-3-phenyl-1H-1,2,4-triazole-1-carboxylate
Wiley ID 1797221