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1-Amino-2-mercapto-5-[1-(4-ethoxyphenyl)-5-methyl-1,2,3-triazol-4-yl]-1,3,4-triazole
SpectraBase Compound ID 14mm3ZO2HZG
InChI InChI=1S/C13H15N7OS/c1-3-21-10-6-4-9(5-7-10)20-8(2)11(15-18-20)12-16-17-13(22)19(12)14/h4-7H,3,14H2,1-2H3,(H,17,22)
InChIKey NXRGEXAPMOWWHT-UHFFFAOYSA-N
Mol Weight 317.37 g/mol
Molecular Formula C13H15N7OS
Exact Mass 317.105879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5YAO8LMsLuZ
Name 1-Amino-2-mercapto-5-[1-(4-ethoxyphenyl)-5-methyl-1,2,3-triazol-4-yl]-1,3,4-triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15N7OS
InChI InChI=1S/C13H15N7OS/c1-3-21-10-6-4-9(5-7-10)20-8(2)11(15-18-20)12-16-17-13(22)19(12)14/h4-7H,3,14H2,1-2H3,(H,17,22)
InChIKey NXRGEXAPMOWWHT-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200500015
Molecular Weight 317.371 g/mol
SMILES N[n]1c(nnc1S)-c1nn[n](c1C)-c1ccc(cc1)OCC
SPLASH splash10-05fr-5900000000-441c0306433e53083720
Source of Spectrum QA-52-105-8
Synonyms 4-Amino-5-(1-(4-ethoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl)-4H-1,2,4-triazole-3-thiol
Wiley ID 1796041