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4-(alpha,alpha,alpha-trifluoro-o-tolyl)-5-undecyl-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID 8cHP0a4sRzf
InChI InChI=1S/C20H28F3N3S/c1-2-3-4-5-6-7-8-9-10-15-18-24-25-19(27)26(18)17-14-12-11-13-16(17)20(21,22)23/h11-14H,2-10,15H2,1H3,(H,25,27)
InChIKey QTDLPVFLSNWEIY-UHFFFAOYSA-N
Mol Weight 399.52 g/mol
Molecular Formula C20H28F3N3S
Exact Mass 399.195604 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID FazLvXOEtz6
Name 4-(alpha,alpha,alpha-TRIFLUORO-o-TOLYL)-5-UNDECYL-4H-1,2,4-TRIAZOLE-3-THIOL
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28F3N3S
InChI InChI=1S/C20H28F3N3S/c1-2-3-4-5-6-7-8-9-10-15-18-24-25-19(27)26(18)17-14-12-11-13-16(17)20(21,22)23/h11-14H,2-10,15H2,1H3,(H,25,27)
InChIKey QTDLPVFLSNWEIY-UHFFFAOYSA-N
Melting Point 134-136C
Molecular Weight 399.524994
Synonyms TRIAZOLE-3-THIOL, 4H-1,2,4-, 4-/A,A,A-TRIFLUORO-O-TOLYL/-5-UNDECYL-,
Technique KBr WAFER