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4-[(Trimethylsilyl)(phenylthio)methyl]bicyclo[4.3.0]-2-oxanonan-3-one
SpectraBase Compound ID Jtps2xZ9L9R
InChI InChI=1S/C18H26O2SSi/c1-22(2,3)18(21-13-9-5-4-6-10-13)16-14-11-7-8-12-15(14)20-17(16)19/h4-6,9-10,14-16,18H,7-8,11-12H2,1-3H3/t14-,15-,16?,18?/m1/s1
InChIKey FWPAZCZRBVFEOP-RSIVFMTNSA-N
Mol Weight 334.55 g/mol
Molecular Formula C18H26O2SSi
Exact Mass 334.142278 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7MZmgSsmvVy
Name 4-[(Trimethylsilyl)(phenylthio)methyl]bicyclo[4.3.0]-2-oxanonan-3-one
Alternate Name(s) (3aS,7aR)-3-(Phenylsulfanyl-trimethylsilanyl-methyl)-hexahydro-benzofuran-2-one 3-[(phenylsulfanyl)(trimethylsilyl)methyl]hexahydrocyclopenta[b]pyran-2(3H)-one (3aS,7aR)-3-[(phenylthio)-trimethylsilylmethyl]-3a,4,5,6,7,7a-hexahydro-3H-benzofuran-2-one (3aS,7aR)-3-[phenylsulfanyl(trimethylsilyl)methyl]-3a,4,5,6,7,7a-hexahydro-3H-benzofuran-2-one (3aS,7aR)-3-[phenylsulfanyl(trimethylsilyl)methyl]-3a,4,5,6,7,7a-hexahydro-3H-1-benzofuran-2-one
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Formula C18H26O2SSi
InChI InChI=1S/C18H26O2SSi/c1-22(2,3)18(21-13-9-5-4-6-10-13)16-14-11-7-8-12-15(14)20-17(16)19/h4-6,9-10,14-16,18H,7-8,11-12H2,1-3H3/t14-,15-,16?,18?/m1/s1
InChIKey FWPAZCZRBVFEOP-RSIVFMTNSA-N
Molecular Weight 334.549 g/mol
SMILES C1(C(O[C@]2([C@]1(CCCC2)[H])[H])=O)C(Sc1ccccc1)[Si](C)(C)C
SPLASH splash10-00di-9020000000-e10943857e995d17575b
Source of Spectrum J-57-4704-60
Wiley ID 1330921