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1-Diamantanethiol
SpectraBase Compound ID L3h5yiJdEXm
InChI InChI=1S/C14H20S/c15-14-4-11-8-1-7-2-9(11)13(6-14)10(3-7)12(8)5-14/h7-13,15H,1-6H2
InChIKey KZMYBURIWXNPDH-UHFFFAOYSA-N
Mol Weight 220.37 g/mol
Molecular Formula C14H20S
Exact Mass 220.128572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bw1z3ElKWin
Name 1-Diamantanethiol
Alternate Name(s) 4-Diamantanethiol Pentacyclo[7.3.1.1(4,12).0(2,7).0(6,11)]tetradec-4-yl hydrosulfide Pentacyclo[7.3.1.1(4,12).0(2,7).0(6,11)]tetradecane-4-thiol
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Formula C14H20S
InChI InChI=1S/C14H20S/c15-14-4-11-8-1-7-2-9(11)13(6-14)10(3-7)12(8)5-14/h7-13,15H,1-6H2
InChIKey KZMYBURIWXNPDH-UHFFFAOYSA-N
Molecular Weight 220.374 g/mol
SMILES SC12CC3C4C(C2)C2C(C3CC(C2)C4)C1
SPLASH splash10-000i-0900000000-bd8aa30510b5be4cef96
Source of Spectrum AT-31-5420-0
Wiley ID 835866