| SpectraBase Spectrum ID |
4sNKFS7aiHw |
| Name |
2-Butanone, 1-[2-(4-chlorophenyl)ethoxy]-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
321.124404594 u |
| Formula |
C16H20ClN3O2 |
| InChI |
InChI=1S/C16H20ClN3O2/c1-16(2,3)14(21)15(20-11-18-10-19-20)22-9-8-12-4-6-13(17)7-5-12/h4-7,10-11,15H,8-9H2,1-3H3 |
| InChIKey |
JUDNAOSQVJWIHF-UHFFFAOYSA-N |
| Molecular Weight |
321.808 g/mol |
| SMILES |
CC(C)(C)C(C(OCCC1=CC=C(C=C1)Cl)N1N=CN=C1)=O |
![2-Butanone, 1-[2-(4-chlorophenyl)ethoxy]-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)-](/api/spectrum/4sNKFS7aiHw/structure.png?h=300&w=458 "2-Butanone, 1-[2-(4-chlorophenyl)ethoxy]-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)-")
