For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3,5-Methano-2H-cyclopenta[b]furan-2-one, hexahydro-6-(phenylthio)-4-(trimethylsilyl)-, (3.alpha.,3a.beta.,4.beta.,5.alpha.,6.beta.,6a.beta.)-
SpectraBase Compound ID LrJa6IZ93z3
InChI InChI=1S/C17H22O2SSi/c1-21(2,3)16-12-9-11-13(16)14(19-17(11)18)15(12)20-10-7-5-4-6-8-10/h4-8,11-16H,9H2,1-3H3/t11-,12-,13-,14-,15-,16-/m1/s1
InChIKey VXWIGLCTQUEWFN-VUVWGQCBSA-N
Mol Weight 318.51 g/mol
Molecular Formula C17H22O2SSi
Exact Mass 318.110978 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID LbXlUioBhDg
Name 3,5-Methano-2H-cyclopenta[b]furan-2-one, hexahydro-6-(phenylthio)-4-(trimethylsilyl)-, (3.alpha.,3a.beta.,4.beta.,5.alpha.,6.beta.,6a.beta.)-
CAS Registry Number 78824-71-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O2SSi
InChI InChI=1S/C17H22O2SSi/c1-21(2,3)16-12-9-11-13(16)14(19-17(11)18)15(12)20-10-7-5-4-6-8-10/h4-8,11-16H,9H2,1-3H3/t11-,12-,13-,14-,15-,16-/m1/s1
InChIKey VXWIGLCTQUEWFN-VUVWGQCBSA-N
Molecular Weight 318.506 g/mol
SMILES [C@]12([C@@]3([C@](Sc4ccccc4)([C@@]([C@]1([Si](C)(C)C)[H])([H])C[C@]2(C(=O)O3)[H])[H])[H])[H]
SPLASH splash10-0v4i-7609000000-b730ba6c33a01fcafee6
Source of Spectrum KC-1981-1554-0
Synonyms (1R,2R,3R,6R,7R,8S)-2-(phenylsulfanyl)-8-(trimethylsilyl)-4-oxatricyclo[4.2.1.0(3,7)]nonan-5-one 5-exo-phenylthio-7-anti-trimethylsilylbicyclo-[2.2.1]heptane-2,6-carbolactone
Wiley ID 1318443