| SpectraBase Spectrum ID |
KunKNSkpKin |
| Name |
2C-T-31 N,N-bis(3-trifluoromethylbenzyl) |
| Classification |
Phenethylamine designer drug derivative |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
687.185353849 u |
| Formula |
C34H30F9NO2S |
| InChI |
InChI=1S/C34H30F9NO2S/c1-45-29-18-31(47-21-22-9-11-26(12-10-22)32(35,36)37)30(46-2)17-25(29)13-14-44(19-23-5-3-7-27(15-23)33(38,39)40)20-24-6-4-8-28(16-24)34(41,42)43/h3-12,15-18H,13-14,19-21H2,1-2H3 |
| InChIKey |
MSMRMPKXZDZHJT-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
687.665 g/mol |
| Nominal Mass |
687 u |
| Quality |
772 |
| Retention Index |
5017 |
| SMILES |
C(C1=CC=C(CSC2=C(C=C(C(=C2)OC)CCN(CC=2C=C(C(F)(F)F)C=CC2)CC=2C=C(C(F)(F)F)C=CC2)OC)C=C1)(F)(F)F |
| SPLASH |
splash10-0002-1509000000-ca9e7a24bf5ef1c75ea5 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
N,N-Bis(3-trifluoromethylbenzyl)-4-((4-trifluoromethyl)benzylthio)-2,5-dimethoxy-phenethylamine
2-(2,5-dimethoxy-4-((4-(trifluoromethyl)benzyl)sulfanyl)phenyl)-N,N-bis(3-(trifluoromethyl)benzyl)\rethan-1-amine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_020806 |
