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2-(5-MERCAPTO-1,1-DIMETHYL-2-THIAPENTYL)-5-METHYLCYCLOHEXAN-1-ON

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2-(5-MERCAPTO-1,1-DIMETHYL-2-THIAPENTYL)-5-METHYLCYCLOHEXAN-1-ON
SpectraBase Compound ID EXFLboF6e2c
InChI InChI=1S/C13H24OS2/c1-10-5-6-11(12(14)9-10)13(2,3)16-8-4-7-15/h10-11,15H,4-9H2,1-3H3
InChIKey WUXACEDSUFDNSZ-UHFFFAOYSA-N
Mol Weight 260.45 g/mol
Molecular Formula C13H24OS2
Exact Mass 260.126858 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7m8ABsoTz7w
Name 2-{1-[(3-MERCAPTOPROPYL)THIO]-1-METHYLETHYL}-5-METHYLCYCLOHEXANONE
Source of Sample A. Hoppmann, P. Weyerstahl Liebigs Ann. Chem. 1977, 1547
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H24OS2
InChI InChI=1S/C13H24OS2/c1-10-5-6-11(12(14)9-10)13(2,3)16-8-4-7-15/h10-11,15H,4-9H2,1-3H3
InChIKey WUXACEDSUFDNSZ-UHFFFAOYSA-N
Molecular Weight 260.46
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Varian CFT-20
Synonyms CYCLOHEXANONE, 2-/1-//3-MERCAPTOPROPYL/THIO/-1-METHYLETHYL/-5-METHYL-,