5-[(2,3,4,5,6-PENTAMETHYLBENZYL)THIO]-4-(2,4-XYLYL)-4H-1,2,4-TRIAZOLE-3-ACETONITRILE, MONOHYDROCHLORIDE

SpectraBase Compound ID	10qFr6oN8Mf
InChI	InChI=1S/C24H28N4S.ClH/c1-14-8-9-22(15(2)12-14)28-23(10-11-25)26-27-24(28)29-13-21-19(6)17(4)16(3)18(5)20(21)7;/h8-9,12H,10,13H2,1-7H3;1H
InChIKey	JINDQSDKDQPTSG-UHFFFAOYSA-N Google Search
Mol Weight	441.04 g/mol
Molecular Formula	C24H29ClN4S
Exact Mass	440.180146 g/mol

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SpectraBase Spectrum ID	LeNnGguy3VQ
Name	5-[(2,3,4,5,6-PENTAMETHYLBENZYL)THIO]-4-(2,4-XYLYL)-4H-1,2,4-TRIAZOLE-3-ACETONITRILE, MONOHYDROCHLORIDE
Source of Sample	MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Catalog Number	CD 2514
Copyright	Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C24H29ClN4S
InChI	InChI=1S/C24H28N4S.ClH/c1-14-8-9-22(15(2)12-14)28-23(10-11-25)26-27-24(28)29-13-21-19(6)17(4)16(3)18(5)20(21)7;/h8-9,12H,10,13H2,1-7H3;1H
InChIKey	JINDQSDKDQPTSG-UHFFFAOYSA-N
Melting Point	152-155C
Molecular Weight	441.033997
Synonyms	TRIAZOLE-3-ACETONITRILE, 4H-1,2,4-, 5-//2,3,4,5,6-PENTAMETHYLBENZYL/THIO/- 4-/2,4-XYLYL/-, MONOHYDROCHLORIDE
Technique	KBr WAFER