SpectraBase Spectrum ID |
DlwGgx2lATA |
Name |
5-TOET N,N-bis(2-fluorobenzyl) |
Classification |
Amphetamine designer drug |
Comments |
Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
455.209442121 u |
Formula |
C27H31F2NOS |
InChI |
InChI=1S/C27H31F2NOS/c1-5-20-15-26(31-3)23(16-27(20)32-4)14-19(2)30(17-21-10-6-8-12-24(21)28)18-22-11-7-9-13-25(22)29/h6-13,15-16,19H,5,14,17-18H2,1-4H3 |
InChIKey |
BLXCEXZBHOQNAD-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
455.608 g/mol |
Nominal Mass |
455 u |
Quality |
991 |
Retention Index |
3054 |
SMILES |
C=1(C(=CC(=C(C1)SC)CC)OC)CC(N(CC1=C(C=CC=C1)F)CC=1C(=CC=CC1)F)C |
SPLASH |
splash10-03di-0490000000-190897e476794751493a |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
N,N-Bis(2-fluorobenzyl)-1-[4-ethyl-2-methoxy-5-methylthiophenyl]propan-2-amine
1-(4-ethyl-2-methoxy-5-methylthiophenyl)-N,N-bis(2-fluorobenzyl)propan-2-amine |
Technique |
GC/MS |
Wiley ID |
DD2024_020739 |