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4-(1-(1,3-Dithiolan-2-ylidene)propyl)octan-2-one (
SpectraBase Compound ID 8j1WMbtsBaO
InChI InChI=1S/C14H24OS2/c1-4-6-7-12(10-11(3)15)13(5-2)14-16-8-9-17-14/h12H,4-10H2,1-3H3
InChIKey KDAUXNCFMLRQRP-UHFFFAOYSA-N
Mol Weight 272.46 g/mol
Molecular Formula C14H24OS2
Exact Mass 272.126858 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2KbJyBOjCZc
Name 4-(1-(1,3-Dithiolan-2-ylidene)propyl)octan-2-one (
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Formula C14H24OS2
InChI InChI=1S/C14H24OS2/c1-4-6-7-12(10-11(3)15)13(5-2)14-16-8-9-17-14/h12H,4-10H2,1-3H3
InChIKey KDAUXNCFMLRQRP-UHFFFAOYSA-N
Instrument Name Finnigan MAT 90
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.14.37
Reported Formula C14H24O3S2
SMILES C(C(=C1SCCS1)C(CC(C)=O)CCCC)C
SPLASH splash10-0aba-0900000000-357397a2097b95f16ecf
Source of Spectrum BJO-14-SM19-4p
Thin-Layer Chromatography Rf = 0.71 (cyclohexane/ethyl acetate, 2:1)
Wiley ID 1845800