SpectraBase Spectrum ID |
JIx3azNRDou |
Name |
N-(4-Chlorophenyl)-N-(1-[(2-thiophen-2-yl)ethyl]piperidin-4-yl)-4-ethylbenzamide |
Classification |
Fentanyl opioid |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
452.168912435 u |
Formula |
C26H29ClN2OS |
InChI |
InChI=1S/C26H29ClN2OS/c1-2-20-5-7-21(8-6-20)26(30)29(23-11-9-22(27)10-12-23)24-13-16-28(17-14-24)18-15-25-4-3-19-31-25/h3-12,19,24H,2,13-18H2,1H3 |
InChIKey |
HIEYJAPNBAMSKY-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
453.044 g/mol |
Nominal Mass |
452 u |
Quality |
1000 |
Retention Index |
3417 |
SMILES |
C(N(C1CCN(CC1)CCC=1SC=CC1)C1=CC=C(C=C1)Cl)(C1=CC=C(C=C1)CC)=O |
SPLASH |
splash10-053r-2904000000-fc4fd3e549d5e3178f6c |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Fentanyl(-propionyl+(4-Ethylbenzoyl-phenyl+4-chlorophenyl-phenethyl+(thiophen-2-yl-ethyl)) |
Technique |
GC/MS |
Wiley ID |
DD2024_026840 |