MS of 4-Mercapto-3-hexanone

4-Mercapto-3-hexanone

InChiKey: KKOKEJMOQQAZEY-UHFFFAOYSA-N
Retention index: SemiStdNP=987
Formula: C6H12OS
Exact mass: 132.060886
Comments: Spectrum_id=DI-259 Smiles=CCC(C(S)CC)=O Contributor=D.Hendrawan,_S.Schulz,_TU_Braunschweig Reference=https://doi.org/10.1021/jf100623a Phase=DB-5 Mode=Agilent_quadrupole_MS Compound_class=_ Source=thiol_ketone aroma compound License=CC_BY-SA
Structure of 4-Mercapto-3-hexanone