| SpectraBase Spectrum ID |
CTOPTHI1aIl |
| Name |
SEW2871 |
| Source of Sample |
Cayman Chemical Company |
| Catalog Number |
10006440 |
| Lot Number |
0459044-46 |
| CAS Registry Number |
256414-75-2 |
| Cell Type |
Capillary tube |
| Compound Type |
Pure |
| Copyright |
Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H10F6N2OS |
| IUPAC Name |
5-[4-Phenyl-5-(trifluoromethyl)-2-thienyl]-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole |
| InChI |
InChI=1S/C20H10F6N2OS/c21-19(22,23)13-8-4-7-12(9-13)17-27-18(29-28-17)15-10-14(11-5-2-1-3-6-11)16(30-15)20(24,25)26/h1-10H |
| InChIKey |
OYMNPJXKQVTQTR-UHFFFAOYSA-N |
| Molecular Weight |
440.363 g/mol |
| Raman Corrections |
Referenced to internal white light source; 180 degree backscatter |
| Raman Laser Power |
1401 mW |
| Raman Laser Source |
Nd:YAG |
| SMILES |
FC(F)(F)c1cc(-c2nc(-c3sc(c(c3)-c3ccccc3)C(F)(F)F)on2)ccc1 |
| Scans Performed |
1152 |
| Source of Spectrum |
Forensic Spectral Research |
| Technique |
FT-Raman |
