SpectraBase Spectrum ID |
8HwBBvrlR6e |
Name |
2C-T-31 2PE |
Classification |
Phenethylamine designer drug derivative |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
511.273185193 u |
Formula |
C28H40F3NO2S |
InChI |
InChI=1S/C28H40F3NO2S/c1-5-7-9-16-32(17-10-8-6-2)18-15-23-19-26(34-4)27(20-25(23)33-3)35-21-22-11-13-24(14-12-22)28(29,30)31/h11-14,19-20H,5-10,15-18,21H2,1-4H3 |
InChIKey |
BGLNYYODQRGZID-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
511.688 g/mol |
Nominal Mass |
511 u |
Quality |
996 |
Retention Index |
2956 |
SMILES |
C1(C(F)(F)F)=CC=C(C=C1)CSC1=C(C=C(C(=C1)OC)CCN(CCCCC)CCCCC)OC |
SPLASH |
splash10-00di-1900000000-da4727c1fdd56a380ebc |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
N,N-Dipentyl-2,5-dimethoxy-4-(4-trifluoromethyl)benzylthiophenethylamine
N-(2-(2,5-dimethoxy-4-((4-(trifluoromethyl)benzyl)sulfanyl)phenyl)ethyl)-N-pentylpentan-1-amine |
Technique |
GC/MS |
Wiley ID |
DD2024_016546 |