| SpectraBase Spectrum ID |
2kranUCcWxc |
| Name |
N-(1-Benzyl-3-methylpiperidin-4-yl)-N-phenylprolinamide TFA |
| Classification |
3-Methylfentanyl analog |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
473.229011705 u |
| Formula |
C26H30F3N3O2 |
| InChI |
InChI=1S/C26H30F3N3O2/c1-19-17-30(18-20-9-4-2-5-10-20)16-14-22(19)32(21-11-6-3-7-12-21)24(33)23-13-8-15-31(23)25(34)26(27,28)29/h2-7,9-12,19,22-23H,8,13-18H2,1H3/t19-,22-,23-/m0/s1 |
| InChIKey |
YGLXHDTWBHOKNJ-VJBMBRPKSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
473.540 g/mol |
| Nominal Mass |
473 u |
| Quality |
971 |
| Retention Index |
3145 |
| SMILES |
[C@]1(N(C(C(F)(F)F)=O)CCC1)(C(N([C@@]1([C@](CN(CC2=CC=CC=C2)CC1)(C)[H])[H])C1=CC=CC=C1)=O)[H] |
| SPLASH |
splash10-000m-5900000000-d7ec854c207254e894a3 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
(2S)-N-(1-benzyl-3-methylpiperidin-4-yl)-N-phenyl-1-(trifluoroacetyl)pyrrolidine-2-carboxamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_008897 |
