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3-(1,3-Dithian-2-yl)cyclohexanone
SpectraBase Compound ID L5sAvD3MJhX
InChI InChI=1S/C10H16OS2/c11-9-4-1-3-8(7-9)10-12-5-2-6-13-10/h8,10H,1-7H2
InChIKey URASABZBTQJJGX-UHFFFAOYSA-N
Mol Weight 216.36 g/mol
Molecular Formula C10H16OS2
Exact Mass 216.064257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HVBb0Xst1ay
Name 3-(1,3-Dithian-2-yl)cyclohexanone
Comments Less than 3 mono-isotopic peaks
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Formula C10H16OS2
InChI InChI=1S/C10H16OS2/c11-9-4-1-3-8(7-9)10-12-5-2-6-13-10/h8,10H,1-7H2
InChIKey URASABZBTQJJGX-UHFFFAOYSA-N
Molecular Weight 216.357 g/mol
SMILES C1(SCCCS1)C1CC(=O)CCC1
SPLASH splash10-014i-0910000000-2fef48836489ed3bac67
Source of Spectrum SO-0-1177-12
Synonyms 3-(1,3-dithian-2-yl)-1-cyclohexanone
Wiley ID 874936