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(1S,2R,3R,5S)-2-Benzyl-3-thiabicyclo[3.2.1]octane-3-oxide
SpectraBase Compound ID JluXedrIi1f
InChI InChI=1S/C14H18OS/c15-16-10-12-6-7-13(8-12)14(16)9-11-4-2-1-3-5-11/h1-5,12-14H,6-10H2/t12-,13-,14+,16?/m0/s1
InChIKey FHEOMCYGZSQAQF-ZNUWXHPXSA-N
Mol Weight 234.36 g/mol
Molecular Formula C14H18OS
Exact Mass 234.107836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A9cZq1sy5KW
Name (1S,2R,3R,5S)-2-Benzyl-3-thiabicyclo[3.2.1]octane-3-oxide
Alternate Name(s) (1S,2R,5S)-2-benzyl-3-thiabicyclo[3.2.1]octane 3-oxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18OS
InChI InChI=1S/C14H18OS/c15-16-10-12-6-7-13(8-12)14(16)9-11-4-2-1-3-5-11/h1-5,12-14H,6-10H2/t12-,13-,14+,16?/m0/s1
InChIKey FHEOMCYGZSQAQF-ZNUWXHPXSA-N
Molecular Weight 234.357 g/mol
SMILES [C@]1([S@@](C[C@]2(CC[C@]1(C2)[H])[H])=O)(Cc1ccccc1)[H]
SPLASH splash10-0006-9010000000-6aeb1e2543225bd26103
Source of Spectrum F-50-6075-20
Wiley ID 1236076