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6-(1-p-Chlorophenyl-5-methyl-1,2,3-triazol-4-yl)-3-phenyl-s-triazolo[3,4-b]1,3,4-thiadiazole

View entire compound with spectra: 1 MS (GC)

6-(1-p-Chlorophenyl-5-methyl-1,2,3-triazol-4-yl)-3-phenyl-s-triazolo[3,4-b]1,3,4-thiadiazole
SpectraBase Compound ID IgQLXkk9bi3
InChI InChI=1S/C18H12ClN7S/c1-11-15(20-24-25(11)14-9-7-13(19)8-10-14)17-23-26-16(21-22-18(26)27-17)12-5-3-2-4-6-12/h2-10H,1H3
InChIKey WIWGNTLMMSUVJH-UHFFFAOYSA-N
Mol Weight 393.86 g/mol
Molecular Formula C18H12ClN7S
Exact Mass 393.056342 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FnYFSByMezD
Name 6-(1-p-Chlorophenyl-5-methyl-1,2,3-triazol-4-yl)-3-phenyl-s-triazolo[3,4-b]1,3,4-thiadiazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H12ClN7S
InChI InChI=1S/C18H12ClN7S/c1-11-15(20-24-25(11)14-9-7-13(19)8-10-14)17-23-26-16(21-22-18(26)27-17)12-5-3-2-4-6-12/h2-10H,1H3
InChIKey WIWGNTLMMSUVJH-UHFFFAOYSA-N
Molecular Weight 393.856 g/mol
SMILES c12[n](N=C(S2)c2nn[n](c2C)-c2ccc(cc2)Cl)c(nn1)-c1ccccc1
SPLASH splash10-0006-0229000000-4c32c736b73a7ef98f06
Source of Spectrum QA-45-536-3
Synonyms 6-[1-(4-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-3-phenyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Wiley ID 862934