| SpectraBase Spectrum ID |
DjnOaDxjj2e |
| Name |
DOF isothiocyanate |
| Classification |
Amphetamine designer drug |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
255.072928030 u |
| Formula |
C12H14FNO2S |
| InChI |
InChI=1S/C12H14FNO2S/c1-8(14-7-17)4-9-5-12(16-3)10(13)6-11(9)15-2/h5-6,8H,4H2,1-3H3 |
| InChIKey |
AKEUEMZXTGOUGX-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
255.307 g/mol |
| Nominal Mass |
255 u |
| Quality |
982 |
| Retention Index |
1848 |
| SMILES |
C=1(C(=CC(=C(C1)OC)F)OC)CC(N=C=S)C |
| SPLASH |
splash10-014i-1920000000-a6d86f80d0150b9b4b78 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
3-(2,5-Dimethoxy-4-fluorophenyl)-2-isothiocyanatopropane
1-fluoro-4-(2-isothiocyanatopropyl)-2,5-dimethoxybenzene |
| Technique |
GC/MS |
| Wiley ID |
DD2024_016917 |
