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(2R*,6R*)-2-(Methylthio)-6-phenylcyclohexanone

View entire compound with spectra: 1 MS (GC)

(2R*,6R*)-2-(Methylthio)-6-phenylcyclohexanone
SpectraBase Compound ID EI47Wj0LyW4
InChI InChI=1S/C13H16OS/c1-15-12-9-5-8-11(13(12)14)10-6-3-2-4-7-10/h2-4,6-7,11-12H,5,8-9H2,1H3/t11-,12-/m1/s1
InChIKey ASUSYEWTGRMRAT-VXGBXAGGSA-N
Mol Weight 220.33 g/mol
Molecular Formula C13H16OS
Exact Mass 220.092186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JsH3kopGTWG
Name (2R*,6R*)-2-(Methylthio)-6-phenylcyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16OS
InChI InChI=1S/C13H16OS/c1-15-12-9-5-8-11(13(12)14)10-6-3-2-4-7-10/h2-4,6-7,11-12H,5,8-9H2,1H3/t11-,12-/m1/s1
InChIKey ASUSYEWTGRMRAT-VXGBXAGGSA-N
Molecular Weight 220.330 g/mol
SMILES C1([C@@](c2ccccc2)(CCC[C@]1(SC)[H])[H])=O
SPLASH splash10-00di-0970000000-b39cc1429e85d198c11d
Source of Spectrum F-67-2310-9
Wiley ID 1686024