| SpectraBase Spectrum ID |
JH02IKk4NrE |
| Name |
3C-E N,N-bis(3-fluorobenzyl) |
| Classification |
Amphetamine designer drug, stimulant, hallucinogenic |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
455.227200185 u |
| Formula |
C27H31F2NO3 |
| InChI |
InChI=1S/C27H31F2NO3/c1-5-33-27-25(31-3)15-22(16-26(27)32-4)12-19(2)30(17-20-8-6-10-23(28)13-20)18-21-9-7-11-24(29)14-21/h6-11,13-16,19H,5,12,17-18H2,1-4H3 |
| InChIKey |
HBEDDYZNHUHSQS-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
455.546 g/mol |
| Nominal Mass |
455 u |
| Quality |
828 |
| Retention Index |
2954 |
| SMILES |
C=1(C(=CC(=CC1OC)CC(N(CC=1C=C(C=CC1)F)CC=1C=C(C=CC1)F)C)OC)OCC |
| SPLASH |
splash10-0bt9-2940000000-83d9c6a4e57f77ad9ac2 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
N,N-Bis(3-fluorobenzyl)-3,5-dimethoxy-4-ethoxyamphetamine
1-(4-ethoxy-3,5-dimethoxyphenyl)-N,N-bis(3-fluorobenzyl)propan-2-amine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_021112 |
