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2,6-Dimethyl-2-phenylthiomethylbicyclo[4.3.0]nona-1,7-diene
SpectraBase Compound ID DxQO850ERWQ
InChI InChI=1S/C18H22S/c1-17-11-6-10-16(17)18(2,13-7-12-17)14-19-15-8-4-3-5-9-15/h3-6,8-11H,7,12-14H2,1-2H3/t17-,18-/m0/s1
InChIKey OIFGUJQIWRIGAO-ROUUACIJSA-N
Mol Weight 270.43 g/mol
Molecular Formula C18H22S
Exact Mass 270.144222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DpmLpTlfwv9
Name 2,6-Dimethyl-2-phenylthiomethylbicyclo[4.3.0]nona-1,7-diene
Alternate Name(s) (3aR,7R)-3a,7-Dimethyl-7-phenylsulfanylmethyl-4,5,6,7-tetrahydro-3aH-indene
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Formula C18H22S
InChI InChI=1S/C18H22S/c1-17-11-6-10-16(17)18(2,13-7-12-17)14-19-15-8-4-3-5-9-15/h3-6,8-11H,7,12-14H2,1-2H3/t17-,18-/m0/s1
InChIKey OIFGUJQIWRIGAO-ROUUACIJSA-N
Molecular Weight 270.434 g/mol
SMILES C1=2[C@@](C=CC2)(CCC[C@]1(CSc1ccccc1)C)C
SPLASH splash10-0002-2910000000-462508675ceed01a6881
Source of Spectrum QE-4-1486-19
Wiley ID 843705