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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
Mol Weight 441.04 g/mol
Molecular Formula C24H29ClN4S
Exact Mass 440.180146 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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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