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2,2-Dimethyl-2H,6H-thiin-3-one
SpectraBase Compound ID JOFZR4vVsg
InChI InChI=1S/C7H10OS/c1-7(2)6(8)4-3-5-9-7/h3-4H,5H2,1-2H3
InChIKey IMZHPKAEORHOBE-UHFFFAOYSA-N
Mol Weight 142.22 g/mol
Molecular Formula C7H10OS
Exact Mass 142.045236 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JouKM4szQ6W
Name 2,2-Dimethyl-2H,6H-thiin-3-one
Comments Less than 3 mono-isotopic peaks
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Formula C7H10OS
InChI InChI=1S/C7H10OS/c1-7(2)6(8)4-3-5-9-7/h3-4H,5H2,1-2H3
InChIKey IMZHPKAEORHOBE-UHFFFAOYSA-N
Molecular Weight 142.216 g/mol
SMILES C1(C(C=CCS1)=O)(C)C
SPLASH splash10-014l-9600000000-0c6210ab9db6254cb304
Source of Spectrum H-75-2269-9
Synonyms 2,2-dimethyl-2H-thiopyran-3(6H)-one
Wiley ID 1140759