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2-ISOPROPYL-5-METHYLCYCLOHEXAN-1-SPIRO-2'-(1,3-DITHIOLAN);ISOPULEGONETHYLENTHIOACETAL
SpectraBase Compound ID 4J6mXxY9gO1
InChI InChI=1S/C12H20S2/c1-9(2)11-5-4-10(3)8-12(11)13-6-7-14-12/h10-11H,1,4-8H2,2-3H3
InChIKey OKOHARCBYLRTNJ-UHFFFAOYSA-N
Mol Weight 228.41 g/mol
Molecular Formula C12H20S2
Exact Mass 228.100643 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6kTb5NIxLBX
Name 2-Isopropenyl-5-methyl-cyclohexane-1-spiro-2'-(1,3-dithiolane)
Comments *5S,8R
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H20S2
InChI InChI=1S/C12H20S2/c1-9(2)11-5-4-10(3)8-12(11)13-6-7-14-12/h10-11H,1,4-8H2,2-3H3
InChIKey OKOHARCBYLRTNJ-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference A. Hoppmann, P. Weyerstahl, Liebigs Ann. Chem. 1547 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3