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2-{[5-(1-ETHYL-3-METHYLPYRAZOL-5-YL)-4-(alpha,alpha,alpha-TRIFLUORO-m-TOLYL)-4H-1,2,4-TRIAZOL-3-YL]THIO}ACETOPHENONE

View entire compound with spectra: 1 NMR, and 1 FTIR

2-{[5-(1-ETHYL-3-METHYLPYRAZOL-5-YL)-4-(alpha,alpha,alpha-TRIFLUORO-m-TOLYL)-4H-1,2,4-TRIAZOL-3-YL]THIO}ACETOPHENONE
SpectraBase Compound ID F3vOYujr9Lz
InChI InChI=1S/C23H20F3N5OS/c1-3-30-19(12-15(2)29-30)21-27-28-22(33-14-20(32)16-8-5-4-6-9-16)31(21)18-11-7-10-17(13-18)23(24,25)26/h4-13H,3,14H2,1-2H3
InChIKey XFZWWRNALBOMDO-UHFFFAOYSA-N
Mol Weight 471.5 g/mol
Molecular Formula C23H20F3N5OS
Exact Mass 471.134066 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 4PvyjQGIpEg
Name 2-{[5-(1-ETHYL-3-METHYLPYRAZOL-5-YL)-4-(alpha,alpha,alpha-TRIFLUORO-m-TOLYL)-4H-1,2,4-TRIAZOL-3-YL]THIO}ACETOPHENONE
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H20F3N5OS
InChI InChI=1S/C23H20F3N5OS/c1-3-30-19(12-15(2)29-30)21-27-28-22(33-14-20(32)16-8-5-4-6-9-16)31(21)18-11-7-10-17(13-18)23(24,25)26/h4-13H,3,14H2,1-2H3
InChIKey XFZWWRNALBOMDO-UHFFFAOYSA-N
Melting Point 155-157C
Molecular Weight 471.51
Technique KBr WAFER