| SpectraBase Spectrum ID |
2oSChxhUSxc |
| Name |
4-Fluorofentanyl |
| CAS Registry Number |
90736-23-5 |
| Classification |
Fentanyl opioid |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| DEA Citation |
21 CFR §1308.11 (b) (72) |
| DEA Controlled Substance Name |
p-Fluorofentanyl |
| DEA Controlled Substance Type |
Isomers, esters, ethers, salts, and salts of isomers, esters and ethers |
| DEA Controlled Substances Code Number |
9812 |
| DEA Schedule |
Schedule I |
| DEA Section |
(b) Opiates. Unless specifically excepted or unless listed in another schedule, any of the following opiates, including their isomers, esters, ethers, salts, and salts of isomers, esters and ethers, whenever the existence of such isomers, esters, ethers and salts is possible within the specific chemical designation (for purposes of 3-methylthiofentanyl only, the term isomer includes the optical and geometric isomers): |
| Exact Mass |
354.210741659 u |
| Formula |
C22H27FN2O |
| InChI |
InChI=1S/C22H27FN2O/c1-2-22(26)25(20-10-8-19(23)9-11-20)21-13-16-24(17-14-21)15-12-18-6-4-3-5-7-18/h3-11,21H,2,12-17H2,1H3 |
| InChIKey |
KXUBAVLIJFTASZ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
354.469 g/mol |
| Nominal Mass |
354 u |
| Quality |
962 |
| Retention Index |
2780 |
| SMILES |
C1(N(C2=CC=C(C=C2)F)C(CC)=O)CCN(CC1)CCC=1C=CC=CC1 |
| SPLASH |
splash10-03di-3690000000-80bdd9dec4285cef9435 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Fentanyl(-phenyl+4-fluorophenyl)
Parafluorofentanyl
p-Fluorofentanyl
para-Fluorofentanyl
N-(4-Fluorophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_023581 |
