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rac-4-Mercapto-2-pentanone
SpectraBase Compound ID Ei5eP2MS7HX
InChI InChI=1S/C5H10OS/c1-4(6)3-5(2)7/h5,7H,3H2,1-2H3
InChIKey KHIPEWLRUGVKIC-UHFFFAOYSA-N
Mol Weight 118.19 g/mol
Molecular Formula C5H10OS
Exact Mass 118.045236 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3zaLVRRUAvh
Name rac-4-Mercapto-2-pentanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H10OS
InChI InChI=1S/C5H10OS/c1-4(6)3-5(2)7/h5,7H,3H2,1-2H3
InChIKey KHIPEWLRUGVKIC-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ffj.3228
Molecular Weight 118.194 g/mol
SMILES SC(CC(C)=O)C
SPLASH splash10-0006-9100000000-8ae7b4ef5304085d8210
Source of Spectrum FF-30-173-1
Synonyms 4-Mercaptopentan-2-one
Wiley ID 1787424