| SpectraBase Spectrum ID |
A3iF1PgVLmX |
| Name |
1-Benzyl-N-(4-Bromomethylphenyl)-N-(4-fluorophenyl)-piperidin-4-amine |
| Classification |
Fentanyl opioid |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
452.126340008 u |
| Formula |
C25H26BrFN2 |
| InChI |
InChI=1S/C25H26BrFN2/c26-22-8-6-21(7-9-22)19-29(24-12-10-23(27)11-13-24)25-14-16-28(17-15-25)18-20-4-2-1-3-5-20/h1-13,25H,14-19H2 |
| InChIKey |
NZIRURSKHIQAGF-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
453.399 g/mol |
| Nominal Mass |
452 u |
| Quality |
998 |
| Retention Index |
3300 |
| SMILES |
C1(N(C=2C=CC(=CC2)F)CC2=CC=C(C=C2)Br)CCN(CC=2C=CC=CC2)CC1 |
| SPLASH |
splash10-00di-4910000000-3059adde95f986a96ba7 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Technique |
GC/MS |
| Wiley ID |
DD2024_026083 |
