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{[4-BUTYL-5-(p-CHLOROPHENYL)-4H-1,2,4-TRIAZOL-3-YL]THIO}ACETIC ACID

View entire compound with spectra: 1 FTIR

{[4-BUTYL-5-(p-CHLOROPHENYL)-4H-1,2,4-TRIAZOL-3-YL]THIO}ACETIC ACID
SpectraBase Compound ID EvWyBPvvnF
InChI InChI=1S/C14H16ClN3O2S/c1-2-3-8-18-13(10-4-6-11(15)7-5-10)16-17-14(18)21-9-12(19)20/h4-7H,2-3,8-9H2,1H3,(H,19,20)
InChIKey ZSFVCESQPSAQHW-UHFFFAOYSA-N
Mol Weight 325.81 g/mol
Molecular Formula C14H16ClN3O2S
Exact Mass 325.065176 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID Iy903ycSvyj
Name {[4-BUTYL-5-(p-CHLOROPHENYL)-4H-1,2,4-TRIAZOL-3-YL]THIO}ACETIC ACID
Source of Sample M. H. Shah, Haffkine Institute, Bombay, India
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16ClN3O2S
InChI InChI=1S/C14H16ClN3O2S/c1-2-3-8-18-13(10-4-6-11(15)7-5-10)16-17-14(18)21-9-12(19)20/h4-7H,2-3,8-9H2,1H3,(H,19,20)
InChIKey ZSFVCESQPSAQHW-UHFFFAOYSA-N
Literature Reference Abstract-Chemical Abstracts= 68, 105106(1968)
Melting Point 127-128C
Molecular Weight 325.811005
Synonyms ACETIC ACID, //4-BUTYL-5-/P-CHLORO- PHENYL/-4H-1,2,4-TRIAZOL-3-YL/THIO/-,
Technique KBr WAFER