| SpectraBase Spectrum ID |
Dmxkab4imnY |
| Name |
2C-T-31 iBUT |
| Classification |
Phenethylamine designer drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
441.158549361 u |
| Formula |
C22H26F3NO3S |
| InChI |
InChI=1S/C22H26F3NO3S/c1-14(2)21(27)26-10-9-16-11-19(29-4)20(12-18(16)28-3)30-13-15-5-7-17(8-6-15)22(23,24)25/h5-8,11-12,14H,9-10,13H2,1-4H3,(H,26,27) |
| InChIKey |
CSTCLOVSEQHKSD-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
441.509 g/mol |
| Nominal Mass |
441 u |
| Quality |
998 |
| Retention Index |
2824 |
| SMILES |
C1(=C(C=C(C(=C1)OC)CCNC(C(C)C)=O)OC)SCC1=CC=C(C(F)(F)F)C=C1 |
| SPLASH |
splash10-0udl-5609200000-be6268e6f32527050b9f |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
N-[2-(2,5-Dimethoxy-4-(4-trifluormethylthiobenzyl)phenyl)ethyl]isobutanamide
N-(2-(2,5-dimethoxy-4-((4-(trifluoromethyl)benzyl)sulfanyl)phenyl)ethyl)-2-methylpropanamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_021872 |
