SpectraBase Spectrum ID |
JFHSpABk1kO |
Name |
1-Benzyl-N-(3-fluorophenyl)-N-(3-iodobenzyl)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 |
500.112472008 u |
Formula |
C25H26FIN2 |
InChI |
InChI=1S/C25H26FIN2/c26-22-9-5-11-25(17-22)29(19-21-8-4-10-23(27)16-21)24-12-14-28(15-13-24)18-20-6-2-1-3-7-20/h1-11,16-17,24H,12-15,18-19H2 |
InChIKey |
JRPRNUCUNLSNIG-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
500.400 g/mol |
Nominal Mass |
500 u |
Quality |
1000 |
Retention Index |
3418 |
SMILES |
C1(N(C2CCN(CC=3C=CC=CC3)CC2)CC=2C=C(C=CC2)I)=CC(=CC=C1)F |
SPLASH |
splash10-00dl-3910000000-c026656dd6292360aadc |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Fentanyl(-propionyl+3-iodobenzyl-phenyl+3-fluorophenyl-phenethyl+benzyl) |
Technique |
GC/MS |
Wiley ID |
DD2024_026017 |