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1-Phenyl-2-(5-phenyl-4H-[1,2,4]triazol-3-ylsulfanyl)-ethanone
SpectraBase Compound ID HdoU454lOby
InChI InChI=1S/C16H13N3OS/c20-14(12-7-3-1-4-8-12)11-21-16-17-15(18-19-16)13-9-5-2-6-10-13/h1-10H,11H2,(H,17,18,19)
InChIKey DLNCASBDPGAELF-UHFFFAOYSA-N
Mol Weight 295.36 g/mol
Molecular Formula C16H13N3OS
Exact Mass 295.077933 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3S6OBUY4tk
Name 1-Phenyl-2-(5-phenyl-4H-[1,2,4]triazol-3-ylsulfanyl)-ethanone
Alternate Name(s) 1-Phenyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone 1-Phenyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]ethanone
CAS Registry Number 86812-61-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13N3OS
InChI InChI=1S/C16H13N3OS/c20-14(12-7-3-1-4-8-12)11-21-16-17-15(18-19-16)13-9-5-2-6-10-13/h1-10H,11H2,(H,17,18,19)
InChIKey DLNCASBDPGAELF-UHFFFAOYSA-N
Molecular Weight 295.360 g/mol
SMILES [nH]1c(nnc1-c1ccccc1)SCC(=O)c1ccccc1
SPLASH splash10-0a4i-6920000000-bccef377efbdc890980b
Wiley ID 1459507