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(3'R,4'aR,8'S,8'aR)-3'-(phenylthio)-8'-trimethylsilyloxy-1'-spiro[1,3-dioxolane-2,4'-2,3,4a,5,8,8a-hexahydronaphthalene]one

View entire compound with spectra: 1 MS (GC)

(3'R,4'aR,8'S,8'aR)-3'-(phenylthio)-8'-trimethylsilyloxy-1'-spiro[1,3-dioxolane-2,4'-2,3,4a,5,8,8a-hexahydronaphthalene]one
SpectraBase Compound ID 6RXPgNctmI9
InChI InChI=1S/C21H28O4SSi/c1-27(2,3)25-18-11-7-10-16-20(18)17(22)14-19(21(16)23-12-13-24-21)26-15-8-5-4-6-9-15/h4-9,11,16,18-20H,10,12-14H2,1-3H3/t16-,18+,19-,20+/m1/s1
InChIKey YKJKCESVRUJQHF-MDNKFWRPSA-N
Mol Weight 404.6 g/mol
Molecular Formula C21H28O4SSi
Exact Mass 404.147757 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2PHjkoEoRQU
Name (3'R,4'aR,8'S,8'aR)-3'-(phenylthio)-8'-trimethylsilyloxy-1'-spiro[1,3-dioxolane-2,4'-2,3,4a,5,8,8a-hexahydronaphthalene]one
Alternate Name(s) (3'R,4'aR,8'S,8'aR)-3'-(phenylthio)-8'-trimethylsilyloxy-spiro[1,3-dioxolane-2,4'-2,3,4a,5,8,8a-hexahydronaphthalene]-1'-one (3'R,4'aR,8'S,8'aR)-3'-phenylsulfanyl-8'-trimethylsilyloxy-spiro[1,3-dioxolane-2,4'-2,3,4a,5,8,8a-hexahydronaphthalene]-1'-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28O4SSi
InChI InChI=1S/C21H28O4SSi/c1-27(2,3)25-18-11-7-10-16-20(18)17(22)14-19(21(16)23-12-13-24-21)26-15-8-5-4-6-9-15/h4-9,11,16,18-20H,10,12-14H2,1-3H3/t16-,18+,19-,20+/m1/s1
InChIKey YKJKCESVRUJQHF-MDNKFWRPSA-N
Molecular Weight 404.596 g/mol
SMILES C12([C@]3([C@@]([C@@](O[Si](C)(C)C)(C=CC3)[H])([H])C(C[C@]1(Sc1ccccc1)[H])=O)[H])OCCO2
SPLASH splash10-016r-8900000000-61a445f96c6c25e63e2a
Source of Spectrum F-56-3607-12
Wiley ID 857210