| SpectraBase Spectrum ID |
JJTsFAvEVSS |
| Name |
N-(3-Bromophenyl)-N-(1-(2-phenylethyl)piperidin-4-yl)-1,3-benzodioxole-5-carboxamide |
| Classification |
Fentanyl opioid |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
506.120505734 u |
| Formula |
C27H27BrN2O3 |
| InChI |
InChI=1S/C27H27BrN2O3/c28-22-7-4-8-24(18-22)30(27(31)21-9-10-25-26(17-21)33-19-32-25)23-12-15-29(16-13-23)14-11-20-5-2-1-3-6-20/h1-10,17-18,23H,11-16,19H2 |
| InChIKey |
PMTAUJNQFJHNEC-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
507.428 g/mol |
| Nominal Mass |
506 u |
| Quality |
1000 |
| Retention Index |
3768 |
| SMILES |
C(N(C1CCN(CC1)CCC=1C=CC=CC1)C=1C=C(C=CC1)Br)(C=1C=C2C(=CC1)OCO2)=O |
| SPLASH |
splash10-0002-1900100000-1bc79f59bdc4b2f13d59 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Fentanyl(-propionyl+(1,3-benzodioxole-5-carbonyl)-phenyl+(3-bromophenyl)) |
| Technique |
GC/MS |
| Wiley ID |
DD2024_034051 |
