| SpectraBase Spectrum ID |
8d9OPCCJymG |
| Name |
Ortho-fluoroisobutyryl fentanyl hydrochloride |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
404.203069456 u |
| Formula |
C23H30ClFN2O |
| InChI |
InChI=1S/C23H29FN2O.ClH/c1-18(2)23(27)26(22-11-7-6-10-21(22)24)20-13-16-25(17-14-20)15-12-19-8-4-3-5-9-19;/h3-11,18,20H,12-17H2,1-2H3;1H |
| InChIKey |
LFBJUPYGJBDTQL-UHFFFAOYSA-N |
| Molecular Weight |
404.957 g/mol |
| SMILES |
C=1C(=CC=CC1)CCN1CCC(CC1)N(C=1C(=CC=CC1)F)C(C(C)C)=O.Cl |
| Spectrum/Structure Validation Score (Raman) |
0.995909 |
