| SpectraBase Spectrum ID |
LTySWcdGvV2 |
| Name |
1H-1,2,4-Triazole-1-methanol, 3-[[(4-chlorophenyl)methyl]thio]-.alpha.,.alpha.-dimethyl-, acetate (ester) |
| CAS Registry Number |
112390-26-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H16ClN3O2S |
| InChI |
InChI=1S/C14H16ClN3O2S/c1-10(19)20-14(2,3)18-9-16-13(17-18)21-8-11-4-6-12(15)7-5-11/h4-7,9H,8H2,1-3H3 |
| InChIKey |
PSZGHIZUPLFONV-UHFFFAOYSA-N |
| Molecular Weight |
325.814 g/mol |
| SMILES |
c1(n[n](cn1)C(OC(=O)C)(C)C)SCc1ccc(cc1)Cl |
| SPLASH |
splash10-004i-6960000000-8d8f19c778b37f71449f |
| Source of Spectrum |
KC-1987-1571-7 |
| Synonyms |
1-{3-[(4-chlorobenzyl)sulfanyl]-1H-1,2,4-triazol-1-yl}-1-methylethyl acetate |
| Wiley ID |
1323836 |
![1H-1,2,4-Triazole-1-methanol, 3-[[(4-chlorophenyl)methyl]thio]-.alpha.,.alpha.-dimethyl-, acetate (ester)](/api/spectrum/LTySWcdGvV2/structure.png?h=300&w=458 "1H-1,2,4-Triazole-1-methanol, 3-[[(4-chlorophenyl)methyl]thio]-.alpha.,.alpha.-dimethyl-, acetate (ester)")
