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2-methyl-2-[(8R)-8-methylundecyl]-1,3-dithiane
SpectraBase Compound ID 9Oitikk7j8H
InChI InChI=1S/C17H34S2/c1-4-11-16(2)12-8-6-5-7-9-13-17(3)18-14-10-15-19-17/h16H,4-15H2,1-3H3/t16-/m1/s1
InChIKey BPORISNYGVDBGK-MRXNPFEDSA-N
Mol Weight 302.6 g/mol
Molecular Formula C17H34S2
Exact Mass 302.210193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L0kzl0CaQiX
Name 2-methyl-2-[(8R)-8-methylundecyl]-1,3-dithiane
Appearance Colorless oil
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Formula C17H34S2
InChI InChI=1S/C17H34S2/c1-4-11-16(2)12-8-6-5-7-9-13-17(3)18-14-10-15-19-17/h16H,4-15H2,1-3H3/t16-/m1/s1
InChIKey BPORISNYGVDBGK-MRXNPFEDSA-N
Ionization Type EI
Optical Rotation [a]D26 = -1.55 (c = 0.57, CHCl3)
SMILES C(CCC[C@@](CCC)(C)[H])CCCC1(C)SCCCS1
SPLASH splash10-001i-0910000000-d723a55e1a245c15b841
Source of Spectrum CN101050211B
Wiley ID 1841418