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S-Phenyl 2,2-dimethyl-6-methylidenecyclohexane-1-carbothioate
SpectraBase Compound ID EAKK5LTCxsW
InChI InChI=1S/C16H20OS/c1-12-8-7-11-16(2,3)14(12)15(17)18-13-9-5-4-6-10-13/h4-6,9-10,14H,1,7-8,11H2,2-3H3/t14-/m0/s1
InChIKey QVGQAKMSXIHFMA-AWEZNQCLSA-N
Mol Weight 260.39 g/mol
Molecular Formula C16H20OS
Exact Mass 260.123486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8YvHAQOC6ug
Name S-Phenyl 2,2-dimethyl-6-methylidenecyclohexane-1-carbothioate
Alternate Name(s) (S)-S-Phenyl 2,2-dimethyl-6-methylidenecyclohexane-1-carbothioate S-phenyl 2,2-dimethyl-6-methylenecyclohexanecarbothioate
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Formula C16H20OS
InChI InChI=1S/C16H20OS/c1-12-8-7-11-16(2,3)14(12)15(17)18-13-9-5-4-6-10-13/h4-6,9-10,14H,1,7-8,11H2,2-3H3/t14-/m0/s1
InChIKey QVGQAKMSXIHFMA-AWEZNQCLSA-N
Molecular Weight 260.395 g/mol
SMILES C([C@@]1(C(=C)CCCC1(C)C)[H])(Sc1ccccc1)=O
SPLASH splash10-00di-5900000000-01d0e9faa35b11e63b7a
Source of Spectrum H-78-550-24
Wiley ID 1263970