![4-methyl-5-[(2,3,4,5,6-pentamethylbenzyl)thio]-4H-1,2,4-triazole-3-acetonitrile](/api/spectrum/CwjQQrSd1xJ/structure.png?h=300&w=458 "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 |
Ultraviolet-Visible (UV-Vis) Spectrum
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| SpectraBase Spectrum ID | CwjQQrSd1xJ |
|---|---|
| Name | 4-methyl-5-[(2,3,4,5,6-pentamethylbenzyl)thio]-4H-1,2,4-triazole-3-acetonitrile |
| Conditions | Neutral |
| Copyright | Copyright © 2008-2024 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 |
| Sadtler IR Number | 53901 |
| Sadtler UV Number | 28448N |
| Solvent | Methanol |