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2-[2-(Trifluoromethyl)heptyl]-1,3-dithiane
SpectraBase Compound ID 1cDO2aSYTUg
InChI InChI=1S/C12H21F3S2/c1-2-3-4-6-10(12(13,14)15)9-11-16-7-5-8-17-11/h10-11H,2-9H2,1H3
InChIKey RTKFZLYNRXYGFB-UHFFFAOYSA-N
Mol Weight 286.42 g/mol
Molecular Formula C12H21F3S2
Exact Mass 286.103678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CImWc46dl0z
Name 2-[2-(Trifluoromethyl)heptyl]-1,3-dithiane
Comments Less than 3 mono-isotopic peaks
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Formula C12H21F3S2
InChI InChI=1S/C12H21F3S2/c1-2-3-4-6-10(12(13,14)15)9-11-16-7-5-8-17-11/h10-11H,2-9H2,1H3
InChIKey RTKFZLYNRXYGFB-UHFFFAOYSA-N
Molecular Weight 286.415 g/mol
SMILES C1(SCCCS1)CC(CCCCC)C(F)(F)F
SPLASH splash10-014i-0910000000-177e4854f62dc39727df
Source of Spectrum SO-0-967-5
Wiley ID 1543624