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4-(p-methoxyphenyl)-5-[(2,3,4,5,6-pentamethylbenzyl)thio]-4H-1,2,4-triazole-3-acetonitrile

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4-(p-methoxyphenyl)-5-[(2,3,4,5,6-pentamethylbenzyl)thio]-4H-1,2,4-triazole-3-acetonitrile
SpectraBase Compound ID LX81DwLUZ9I
InChI InChI=1S/C23H26N4OS/c1-14-15(2)17(4)21(18(5)16(14)3)13-29-23-26-25-22(11-12-24)27(23)19-7-9-20(28-6)10-8-19/h7-10H,11,13H2,1-6H3
InChIKey GWZRJWVTGYSJPF-UHFFFAOYSA-N
Mol Weight 406.55 g/mol
Molecular Formula C23H26N4OS
Exact Mass 406.182733 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 15XxdVvJi4O
Name 4-(p-METHOXYPHENYL)-5-[(2,3,4,5,6-PENTAMETHYLBENZYL)THIO]4H-1,2,4-TRIAZOLE-3-ACETONITRILE
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Catalog Number CD 2680
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H26N4OS
InChI InChI=1S/C23H26N4OS/c1-14-15(2)17(4)21(18(5)16(14)3)13-29-23-26-25-22(11-12-24)27(23)19-7-9-20(28-6)10-8-19/h7-10H,11,13H2,1-6H3
InChIKey GWZRJWVTGYSJPF-UHFFFAOYSA-N
Melting Point 171-173C
Molecular Weight 406.548004
Synonyms TRIAZOLE-3-ACETONITRILE, 4H-1,2,4-, 4-/P-METHOXYPHENYL/-5-//2,3,4,5,6- PENTAMETHYLBENZYL/THIO/-,
Technique KBr WAFER