SpectraBase Spectrum ID |
DnenfGGfc3s |
Name |
Methyl-4-methylthio butyrate |
CAS Registry Number |
24310-22-3 |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
148.055800798 u |
Formula |
C6H12O2S |
InChI |
InChI=1S/C6H12O2S/c1-8-6(7)4-3-5-9-2/h3-5H2,1-2H3 |
InChIKey |
HQDLZISNHUMXEA-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
148.220 g/mol |
Nominal Mass |
148 u |
Quality |
816 |
Retention Index |
970 |
SMILES |
C(CCCSC)(OC)=O |
SPLASH |
splash10-02mj-9300000000-6b0d071af040db3d4096 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
methyl 4-methylthiobutanoate |
Technique |
GC/MS |
Wiley ID |
DD2024_007049 |