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2-(Butylthio)adamantane
SpectraBase Compound ID B9r7O3h0T3j
InChI InChI=1S/C14H24S/c1-2-3-4-15-14-12-6-10-5-11(8-12)9-13(14)7-10/h10-14H,2-9H2,1H3/t10-,11+,12-,13+,14?
InChIKey CKQGELKXIBYKRP-VEDUHTKKSA-N
Mol Weight 224.41 g/mol
Molecular Formula C14H24S
Exact Mass 224.159872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 33qxMHCR4OZ
Name 2-(Butylthio)adamantane
Alternate Name(s) ((1r,3r,5r,7r)-adamantan-2-yl)(butyl)sulfane
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Formula C14H24S
InChI InChI=1S/C14H24S/c1-2-3-4-15-14-12-6-10-5-11(8-12)9-13(14)7-10/h10-14H,2-9H2,1H3/t10-,11+,12-,13+,14?
InChIKey CKQGELKXIBYKRP-VEDUHTKKSA-N
Literature Reference DOI 10.1002/hlca.19740570226
Molecular Weight 224.406 g/mol
SMILES C1[C@]2(C[C@]3(C[C@@]1(C[C@@](C2)(C3SCCCC)[H])[H])[H])[H]
SPLASH splash10-000i-5930000000-7ec0984553f36da87200
Source of Spectrum H-57-506-50
Wiley ID 1797181