| SpectraBase Spectrum ID |
2mp5gLGn84G |
| Name |
Fenethylline PFP |
| Classification |
Pharmaceutical drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
487.164280400 u |
| Formula |
C21H22F5N5O3 |
| InChI |
InChI=1S/C21H22F5N5O3/c1-13(11-14-7-5-4-6-8-14)31(18(33)20(22,23)21(24,25)26)10-9-30-12-27-16-15(30)17(32)29(3)19(34)28(16)2/h4-8,12-13H,9-11H2,1-3H3 |
| InChIKey |
OWWXUFQSUBGTPK-UHFFFAOYSA-N |
| Ionization Type |
Chemical Ionization (CI) |
| Molecular Weight |
487.431 g/mol |
| Nominal Mass |
487 u |
| Reagent Gas |
Methane |
| Retention Index |
3856 |
| SMILES |
C12=C(N(C(N(C2=O)C)=O)C)N=CN1CCN(C(C(C(F)(F)F)(F)F)=O)C(CC=1C=CC=CC1)C |
| SPLASH |
splash10-000i-0100910000-0af51e9cc0b4b7285975 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
N-(2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)ethyl)-2,2,3,3,3-pentafluoro-N-\r(1-phenylpropan-2-yl)propanamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_001409 |
