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

SpectraBase Compound ID	DrkK8cnxfvx
InChI	InChI=1S/C14H16ClN3O2S/c1-2-3-7-18-13(10-5-4-6-11(15)8-10)16-17-14(18)21-9-12(19)20/h4-6,8H,2-3,7,9H2,1H3,(H,19,20)
InChIKey	BNGGUEOFXCQVPN-UHFFFAOYSA-N Google Search
Mol Weight	325.81 g/mol
Molecular Formula	C14H16ClN3O2S
Exact Mass	325.065176 g/mol

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SpectraBase Spectrum ID	92f9ahwtvR7
Name	{[4-BUTYL-5-(m-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/c1-2-3-7-18-13(10-5-4-6-11(15)8-10)16-17-14(18)21-9-12(19)20/h4-6,8H,2-3,7,9H2,1H3,(H,19,20)
InChIKey	BNGGUEOFXCQVPN-UHFFFAOYSA-N
Literature Reference	Abstract-Chemical Abstracts= 68, 105106(1968)
Melting Point	132-134C
Molecular Weight	325.811005
Synonyms	ACETIC ACID, //4-BUTYL-5-/M-CHLORO- PHENYL/-4H-1,2,4-TRIAZOL-3-YL/THIO/-,
Technique	KBr WAFER