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1-Cyano-3-methyl-1-thiomethyl-3-cyclohexene

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1-Cyano-3-methyl-1-thiomethyl-3-cyclohexene
SpectraBase Compound ID JIwJ9VHjttQ
InChI InChI=1S/C9H13NS/c1-8-4-3-5-9(6-8,7-10)11-2/h4H,3,5-6H2,1-2H3
InChIKey JCTNABDYXKCMTO-UHFFFAOYSA-N
Mol Weight 167.27 g/mol
Molecular Formula C9H13NS
Exact Mass 167.076871 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GmV8Y7FFEr0
Name 1-CYANO-3-METHYL-1-THIOMETHYL-3-CYCLOHEXENE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H13NS
InChI InChI=1S/C9H13NS/c1-8-4-3-5-9(6-8,7-10)11-2/h4H,3,5-6H2,1-2H3
InChIKey JCTNABDYXKCMTO-UHFFFAOYSA-N
Literature Reference Author J.L.BOUCHER,L.STELLA
Literature Reference Citation TETRAHEDRON,42,3871(1986)
Literature Reference DOI 10.1016/S0040-4020(01)87541-4
Molecular Weight 167.269 g/mol
Solvent CDCl3
Source File Reference UWGB8