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(5-endo-6-exo)-6-chloro-5-p-tolylsulfinylbicyclo[2.2.2]octane-2-one
SpectraBase Compound ID 1eG2VIL76w0
InChI InChI=1S/C15H17ClO2S/c1-9-2-5-11(6-3-9)19(18)15-10-4-7-12(14(15)16)13(17)8-10/h2-3,5-6,10,12,14-15H,4,7-8H2,1H3/t10-,12+,14+,15+,19?/m0/s1
InChIKey OORGGZRSZRJKKB-UJUKAHCHSA-N
Mol Weight 296.81 g/mol
Molecular Formula C15H17ClO2S
Exact Mass 296.063779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1KxA1uR7mQB
Name (5-endo-6-exo)-6-chloro-5-p-tolylsulfinylbicyclo[2.2.2]octane-2-one
CAS Registry Number 106988-60-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17ClO2S
InChI InChI=1S/C15H17ClO2S/c1-9-2-5-11(6-3-9)19(18)15-10-4-7-12(14(15)16)13(17)8-10/h2-3,5-6,10,12,14-15H,4,7-8H2,1H3/t10-,12+,14+,15+,19?/m0/s1
InChIKey OORGGZRSZRJKKB-UJUKAHCHSA-N
Molecular Weight 296.812 g/mol
SMILES [C@]1([C@@]([C@@]2(CC[C@]1(CC2=O)[H])[H])(Cl)[H])(S(c1ccc(cc1)C)=O)[H]
SPLASH splash10-0006-9800000000-436c9682603b9aa4c189
Source of Spectrum K-120-710-6
Synonyms 6-Chloro-5-[(4-methylphenyl)sulfinyl]bicyclo[2.2.2]octan-2-one
Wiley ID 1298840