| SpectraBase Spectrum ID |
JN4fuEqYa2J |
| Name |
Hexaconazole |
| Source of Sample |
Cayman Chemical Company |
| Catalog Number |
24118 |
| Lot Number |
0528106-1 |
| CAS Registry Number |
79983-71-4 |
| Cell Type |
NMR tube |
| Compound Type |
Pure |
| Copyright |
Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H17Cl2N3O |
| IUPAC Name |
α-Butyl-α-(2,4-dichlorophenyl)-1H-1,2,4-triazole-1-ethanol |
| InChI |
InChI=1S/C14H17Cl2N3O/c1-2-3-6-14(20,8-19-10-17-9-18-19)12-5-4-11(15)7-13(12)16/h4-5,7,9-10,20H,2-3,6,8H2,1H3 |
| InChIKey |
STMIIPIFODONDC-UHFFFAOYSA-N |
| Raman Corrections |
Referenced to internal white light source; 180 degree backscatter |
| Raman Laser Power |
1200 mW |
| Raman Laser Source |
Nd:YAG |
| SMILES |
OC(c1ccc(cc1Cl)Cl)(C[n]1cncn1)CCCC |
| Scans Performed |
2176 |
| Source of Spectrum |
Forensic Spectral Research |
| Synonyms |
(+/-)-Hexaconazole |
| Technique |
FT-Raman |
