| SpectraBase Spectrum ID |
CUFh5Yqu1tX |
| Name |
A-771726 |
| Source of Sample |
Cayman Chemical Company |
| Catalog Number |
14404 |
| Lot Number |
0474764-6 |
| CAS Registry Number |
163451-81-8 |
| Cell Type |
Capillary tube |
| Compound Type |
Pure |
| Copyright |
Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H9F3N2O2 |
| IUPAC Name |
2-Cyano-3-hydroxy-N-[4-(trifluoromethyl)phenyl]-2Z-butenamide |
| InChI |
InChI=1S/C12H9F3N2O2/c1-7(18)10(6-16)11(19)17-9-4-2-8(3-5-9)12(13,14)15/h2-5,18H,1H3,(H,17,19)/b10-7- |
| InChIKey |
UTNUDOFZCWSZMS-YFHOEESVSA-N |
| Raman Corrections |
Referenced to internal white light source; 180 degree backscatter |
| Raman Laser Power |
1299 mW |
| Raman Laser Source |
Nd:YAG |
| SMILES |
N(c1ccc(cc1)C(F)(F)F)C(\C(=C\(C)O)C#N)=O |
| Scans Performed |
1344 |
| Source of Spectrum |
Forensic Spectral Research |
| Synonyms |
Flucyamide; HMR 1726; SU 20; Teriflunomide |
| Technique |
FT-Raman |
