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2-[5-(3-Fluoro-phenyl)-4-phenyl-4H-[1,2,4]triazol-3-ylsulfanyl]-acetamide
SpectraBase Compound ID 1LPds9q04mJ
InChI InChI=1S/C16H13FN4OS/c17-12-6-4-5-11(9-12)15-19-20-16(23-10-14(18)22)21(15)13-7-2-1-3-8-13/h1-9H,10H2,(H2,18,22)
InChIKey QZSDHFHXARPUEP-UHFFFAOYSA-N
Mol Weight 328.37 g/mol
Molecular Formula C16H13FN4OS
Exact Mass 328.07941 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DPsbf9WvRej
Name 2-[5-(3-Fluoro-phenyl)-4-phenyl-4H-[1,2,4]triazol-3-ylsulfanyl]-acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13FN4OS
InChI InChI=1S/C16H13FN4OS/c17-12-6-4-5-11(9-12)15-19-20-16(23-10-14(18)22)21(15)13-7-2-1-3-8-13/h1-9H,10H2,(H2,18,22)
InChIKey QZSDHFHXARPUEP-UHFFFAOYSA-N
Molecular Weight 328.365 g/mol
SMILES NC(CSc1[n](c(nn1)-c1cc(F)ccc1)-c1ccccc1)=O
SPLASH splash10-002f-9420000000-5d3ed6733571d3eb7e92
Synonyms 2-[[5-(3-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide 2-[[5-(3-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide 2-[[5-(3-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]acetamide
Wiley ID 1454737