SpectraBase Spectrum ID |
B246PJlS0bQ |
Name |
2C-T-31 TFA |
Classification |
Phenethylamine designer drug derivative |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
467.098983625 u |
Formula |
C20H19F6NO3S |
InChI |
InChI=1S/C20H19F6NO3S/c1-29-15-10-17(31-11-12-3-5-14(6-4-12)19(21,22)23)16(30-2)9-13(15)7-8-27-18(28)20(24,25)26/h3-6,9-10H,7-8,11H2,1-2H3,(H,27,28) |
InChIKey |
ZRJDSFPSFSKMCW-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
467.426 g/mol |
Nominal Mass |
467 u |
Quality |
999 |
Retention Index |
2476 |
SMILES |
C=1(C(=CC(=C(C1)OC)SCC1=CC=C(C(F)(F)F)C=C1)OC)CCNC(C(F)(F)F)=O |
SPLASH |
splash10-014l-2906600000-2d66fad97f983145f26e |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
N-Trifluoroacetyl-4-((4-trifluoromethyl)benzylthio)-2,5-dimethoxyphenethylamine
N-(2-(2,5-dimethoxy-4-((4-(trifluoromethyl)benzyl)sulfanyl)phenyl)ethyl)(trifluoro)acetamide |
Technique |
GC/MS |
Wiley ID |
DD2024_021900 |