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(RAC)-1-BENZYLCYCLOHEX-2-ENE-1-THIOL

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(RAC)-1-BENZYLCYCLOHEX-2-ENE-1-THIOL
SpectraBase Compound ID JLVNi1ROqmN
InChI InChI=1S/C13H16S/c14-13(9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1,3-5,7-9,14H,2,6,10-11H2
InChIKey ALTABKXIIAALOF-UHFFFAOYSA-N
Mol Weight 204.33 g/mol
Molecular Formula C13H16S
Exact Mass 204.097272 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8pDChlY4pAJ
Name (RAC)-1-BENZYLCYCLOHEX-2-ENE-1-THIOL
Compound Number 6D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16S
InChI InChI=1S/C13H16S/c14-13(9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1,3-5,7-9,14H,2,6,10-11H2
InChIKey ALTABKXIIAALOF-UHFFFAOYSA-N
Literature Reference Author F.MARR,D.HOPPE
Literature Reference Citation ORG.LETTERS,4,4217(2002)
Literature Reference DOI 10.1021/ol0266828
Molecular Weight 204.330 g/mol
Solvent CDCl3
Source File Reference UWLU35344