| SpectraBase Spectrum ID |
JJHymiRL6xM |
| Name |
4-(Methylmercapto)benzyl acetate |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
196.055800798 u |
| Formula |
C10H12O2S |
| InChI |
InChI=1S/C10H12O2S/c1-8(11)12-7-9-3-5-10(13-2)6-4-9/h3-6H,7H2,1-2H3 |
| InChIKey |
QGQGKWPUVLIBRE-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
196.264 g/mol |
| Nominal Mass |
196 u |
| Quality |
912 |
| Retention Index |
1573 |
| SMILES |
C1(=CC=C(C=C1)SC)COC(=O)C |
| SPLASH |
splash10-000j-1900000000-77df4d863e55bcd22bef |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
4-methylthiobenzyl acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_002293 |
