| SpectraBase Spectrum ID |
DWcYCxAiuTP |
| Name |
Flunitazene HCl |
| Source of Sample |
Cayman Chemical Company |
| Catalog Number |
30279 |
| CAS Registry Number |
2728-91-8 |
| Cell Type |
Capillary tube |
| Copyright |
Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H24ClFN4O2 |
| IUPAC Name |
N,N-Diethyl-2-[(4-fluorophenyl)methyl]-5-nitro-1H-benzimidazole-1-ethanamine, monohydrochloride |
| InChI |
InChI=1S/C20H23FN4O2.ClH/c1-3-23(4-2)11-12-24-19-10-9-17(25(26)27)14-18(19)22-20(24)13-15-5-7-16(21)8-6-15;/h5-10,14H,3-4,11-13H2,1-2H3;1H |
| InChIKey |
OKEXRSNRQKCYRB-UHFFFAOYSA-N |
| Molecular Weight |
406.889 g/mol |
| Purity |
>=98% |
| Raman Corrections |
Referenced to internal white light source; 180 degree backscatter |
| Raman Laser Source |
Nd:YAG |
| SMILES |
Cl.[N+]([O-])(=O)c1ccc2c(c1)nc([n]2CCN(CC)CC)Cc1ccc(cc1)F |
| Scans Performed |
2048 |
| Source of Spectrum |
Forensic Spectral Research |
| Technique |
FT-Raman |
| UV - Neutral Conditions |
UVmax (nm): 241, 301 |
