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(1S,2R,5S)-2-Benzyl-3-thiabicyclo[3.2.1]octane-3,3-dioxide
SpectraBase Compound ID 1smXMoVG4xc
InChI InChI=1S/C14H18O2S/c15-17(16)10-12-6-7-13(8-12)14(17)9-11-4-2-1-3-5-11/h1-5,12-14H,6-10H2/t12-,13-,14+/m0/s1
InChIKey XSDPBSFQMOLLGT-MELADBBJSA-N
Mol Weight 250.36 g/mol
Molecular Formula C14H18O2S
Exact Mass 250.102751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LuiHeGCRwhX
Name (1S,2R,5S)-2-Benzyl-3-thiabicyclo[3.2.1]octane-3,3-dioxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O2S
InChI InChI=1S/C14H18O2S/c15-17(16)10-12-6-7-13(8-12)14(17)9-11-4-2-1-3-5-11/h1-5,12-14H,6-10H2/t12-,13-,14+/m0/s1
InChIKey XSDPBSFQMOLLGT-MELADBBJSA-N
Molecular Weight 250.356 g/mol
SMILES [C@]1(S(C[C@]2(CC[C@]1(C2)[H])[H])(=O)=O)(Cc1ccccc1)[H]
SPLASH splash10-000x-9700000000-c5b732df57975583af91
Source of Spectrum F-50-6075-23
Wiley ID 1253259