SpectraBase Spectrum ID |
df9EYoKwHk |
Name |
2C-T-21.5 HFB |
Classification |
Phenethylamine designer drug derivative |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
473.070718017 u |
Formula |
C16H16F9NO3S |
InChI |
InChI=1S/C16H16F9NO3S/c1-28-9-6-11(30-7-12(17)18)10(29-2)5-8(9)3-4-26-13(27)14(19,20)15(21,22)16(23,24)25/h5-6,12H,3-4,7H2,1-2H3,(H,26,27) |
InChIKey |
AHNDTVINDLPHED-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
473.354 g/mol |
Nominal Mass |
473 u |
Quality |
998 |
Retention Index |
2032 |
SMILES |
C(C(C(NCCC=1C(=CC(=C(C1)OC)SCC(F)F)OC)=O)(F)F)(C(F)(F)F)(F)F |
SPLASH |
splash10-01vk-3790300000-09cb53e007331b62a5ca |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Phenethylamine,N-heptafluorobutyryl-4-(2,2-difluoroethylthio)-2,5-dimethoxy
N-Heptafluorobutyryl-4-(2,2-difluoroethylthio)-2,5-dimethoxyphenethylamine |
Technique |
GC/MS |
Wiley ID |
DD2024_016488 |