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cis-1-Thia-2,6-di-(4-methoxyphenyl)-4-cyclohexanol
SpectraBase Compound ID AfncYLx2YwC
InChI InChI=1S/C19H22O3S/c1-21-16-7-3-13(4-8-16)18-11-15(20)12-19(23-18)14-5-9-17(22-2)10-6-14/h3-10,15,18-20H,11-12H2,1-2H3/t15-,18-,19?/m1/s1
InChIKey HPEJJXOFDZHIQE-AOQMIGQVSA-N
Mol Weight 330.44 g/mol
Molecular Formula C19H22O3S
Exact Mass 330.128966 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8fEcmCYK6ay
Name cis-1-Thia-2,6-di-(4-methoxyphenyl)-4-cyclohexanol
CAS Registry Number 68296-34-4
Comments reassigned
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Formula C19H22O3S
InChI InChI=1S/C19H22O3S/c1-21-16-7-3-13(4-8-16)18-11-15(20)12-19(23-18)14-5-9-17(22-2)10-6-14/h3-10,15,18-20H,11-12H2,1-2H3/t15-,18-,19?/m1/s1
InChIKey HPEJJXOFDZHIQE-AOQMIGQVSA-N
Instrument Name Varian XL-100
Literature Reference K. Ramalingam, K.D. Berlin, J. Org. Chem. 44, 471 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3