| SpectraBase Spectrum ID |
8GCPj1vnwtU |
| Name |
2-THAP isothiocyanate |
| Classification |
Aminoethylthiophene 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 |
183.017641642 u |
| Formula |
C8H9NS2 |
| InChI |
InChI=1S/C8H9NS2/c1-7(9-6-10)5-8-3-2-4-11-8/h2-4,7H,5H2,1H3 |
| InChIKey |
FXSBDRPEIZOPNM-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
183.287 g/mol |
| Nominal Mass |
183 u |
| Quality |
999 |
| Retention Index |
1480 |
| SMILES |
C=1(CC(N=C=S)C)SC=CC1 |
| SPLASH |
splash10-0002-9200000000-d720d4afa69f960fdc04 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-(Thiophen-2-yl)-2-isothiocyanatopropane
2-(2-isothiocyanatopropyl)thiophene |
| Technique |
GC/MS |
| Wiley ID |
DD2024_013968 |
