| SpectraBase Spectrum ID |
8IXGD66yvPE |
| Name |
2-Thiothinone |
| CAS Registry Number |
24065-17-6 |
| Classification |
Cathinone analog designer drug |
| Comments |
Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
169.056135151 u |
| Formula |
C8H11NOS |
| InChI |
InChI=1S/C8H11NOS/c1-6(9-2)8(10)7-4-3-5-11-7/h3-6,9H,1-2H3 |
| InChIKey |
DOZQPYDMJMLVKX-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
169.242 g/mol |
| Nominal Mass |
169 u |
| Quality |
1000 |
| Retention Index |
1327 |
| SMILES |
C(C=1SC=CC1)(C(NC)C)=O |
| SPLASH |
splash10-0a4i-9000000000-52ef945f75cd0c121637 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
MTP
Thiothinone
bk-MPA
2-(Methylamino)-1-(thiophen-2-yl)propan-1-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_029167 |
