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4-methyl-5-[(2,3,4,5,6-pentamethylbenzyl)thio]-4H-1,2,4-triazole-3-acetonitrile
SpectraBase Compound ID 8mu4cgkNc5t
InChI InChI=1S/C17H22N4S/c1-10-11(2)13(4)15(14(5)12(10)3)9-22-17-20-19-16(7-8-18)21(17)6/h7,9H2,1-6H3
InChIKey HANDMCWHWMILMT-UHFFFAOYSA-N
Mol Weight 314.45 g/mol
Molecular Formula C17H22N4S
Exact Mass 314.156518 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID Jp1IRaubQcP
Name 4-METHYL-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 2581
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22N4S
InChI InChI=1S/C17H22N4S/c1-10-11(2)13(4)15(14(5)12(10)3)9-22-17-20-19-16(7-8-18)21(17)6/h7,9H2,1-6H3
InChIKey HANDMCWHWMILMT-UHFFFAOYSA-N
Melting Point 210-212C
Molecular Weight 314.450989
Synonyms TRIAZOLE-3-ACETONITRILE, 4H-1,2,4-, 4-METHYL-5-//2,3,4,5,6-PENTAMETHYL- BENZYL/THIO/-,
Technique KBr WAFER