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4-(alpha,alpha,alpha,alpha',alpha',alpha'-HEXAFLUORO-3,5-XYLYL)-3-(p-HYDROXYPHENETHYL)-DELTA^2-1,2,4-TRIAZOLINE-5-THIONE
SpectraBase Compound ID FqwIumNbAZ6
InChI InChI=1S/C18H13F6N3OS/c19-17(20,21)11-7-12(18(22,23)24)9-13(8-11)27-15(25-26-16(27)29)6-3-10-1-4-14(28)5-2-10/h1-2,4-5,7-9,28H,3,6H2,(H,26,29)
InChIKey QEXDNHQSIWTMNH-UHFFFAOYSA-N
Mol Weight 433.37 g/mol
Molecular Formula C18H13F6N3OS
Exact Mass 433.068352 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID Ia6eT15MTgW
Name 4-(alpha,alpha,alpha,alpha',alpha',alpha'-HEXAFLUORO-3,5-XYLYL)-3-(p-HYDROXYPHENETHYL)-DELTA^2-1,2,4-TRIAZOLINE-5-THIONE
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Catalog Number BTB 2381
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13F6N3OS
InChI InChI=1S/C18H13F6N3OS/c19-17(20,21)11-7-12(18(22,23)24)9-13(8-11)27-15(25-26-16(27)29)6-3-10-1-4-14(28)5-2-10/h1-2,4-5,7-9,28H,3,6H2,(H,26,29)
InChIKey QEXDNHQSIWTMNH-UHFFFAOYSA-N
Molecular Weight 433.381989
Synonyms TRIAZOLINE-5-THIONE, D<2-1,2,4-, 4-/A,A,A,A*,A*,A*-HEXAFLUORO- 3,5-XYLYL/-3-/P-HYDROXYPHENETHYL/-,
Technique KBr WAFER