| SpectraBase Spectrum ID |
2mqBQvKNTsG |
| Name |
4-(Methylmercapto)benzylmethylketone |
| Classification |
Designer drug precursor |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
180.060886179 u |
| Formula |
C10H12OS |
| InChI |
InChI=1S/C10H12OS/c1-8(11)7-9-3-5-10(12-2)6-4-9/h3-6H,7H2,1-2H3 |
| InChIKey |
RYFZDEIJXAESAA-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
180.265 g/mol |
| Nominal Mass |
180 u |
| Quality |
908 |
| Retention Index |
1262 |
| SMILES |
C=1(CC(=O)C)C=CC(=CC1)SC |
| SPLASH |
splash10-000i-2900000000-048313096b1aa1121761 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-(4-methylthiophenyl)propan-2-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_002295 |
