| SpectraBase Spectrum ID |
8KIbiGDqRSS |
| Name |
2C-T-31 PR |
| Classification |
Phenethylamine designer drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
413.163634742 u |
| Formula |
C21H26F3NO2S |
| InChI |
InChI=1S/C21H26F3NO2S/c1-4-10-25-11-9-16-12-19(27-3)20(13-18(16)26-2)28-14-15-5-7-17(8-6-15)21(22,23)24/h5-8,12-13,25H,4,9-11,14H2,1-3H3 |
| InChIKey |
ABBCRUFOFRMPIJ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
413.499 g/mol |
| Nominal Mass |
413 u |
| Quality |
821 |
| Retention Index |
2500 |
| SMILES |
C(C=1C=CC(CSC2=C(C=C(C(=C2)OC)CCNCCC)OC)=CC1)(F)(F)F |
| SPLASH |
splash10-00di-9302000000-1f1f6e44db1f3cf5e14e |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
N-Propyl-2,5-dimethoxy-4-(4-trifluoromethyl)benzylthiophenethylamine
N-(2-(2,5-dimethoxy-4-((4-(trifluoromethyl)benzyl)sulfanyl)phenyl)ethyl)propan-1-amine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_016543 |
