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exo-8-Bromo-exo-9-acetoxy-endo-4-thiatricyclo[5.2.1.0(2,6)]decane-4,4'-dioxide
SpectraBase Compound ID YEkvwGtSZ5
InChI InChI=1S/C11H15BrO4S/c1-5(13)16-11-7-2-6(10(11)12)8-3-17(14,15)4-9(7)8/h6-11H,2-4H2,1H3/t6-,7+,8?,9?,10-,11+/m1/s1
InChIKey BTFLTFDKXQBXLH-XTNHUSNXSA-N
Mol Weight 323.2 g/mol
Molecular Formula C11H15BrO4S
Exact Mass 321.987443 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LZkzn8Dm5Wk
Name exo-8-Bromo-exo-9-acetoxy-endo-4-thiatricyclo[5.2.1.0(2,6)]decane-4,4'-dioxide
Alternate Name(s) 9-Bromo-4,4-dioxido-4-thiatricyclo[5.2.1.0(2,6)]dec-8-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H15BrO4S
InChI InChI=1S/C11H15BrO4S/c1-5(13)16-11-7-2-6(10(11)12)8-3-17(14,15)4-9(7)8/h6-11H,2-4H2,1H3/t6-,7+,8?,9?,10-,11+/m1/s1
InChIKey BTFLTFDKXQBXLH-XTNHUSNXSA-N
Molecular Weight 323.201 g/mol
SMILES C1S(CC2[C@]3([C@@]([C@@]([C@@](C12)(C3)[H])(Br)[H])(OC(=O)C)[H])[H])(=O)=O
SPLASH splash10-0f6x-9680000000-58200511aad41868b7b7
Source of Spectrum KC-0-2315-23
Wiley ID 822019