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5-METHOXY-3-(PARA-TOLYLTHIOMETHYL)-CYCLOHEXENE
SpectraBase Compound ID 1OycrbVf358
InChI InChI=1S/2C15H20OS/c2*1-12-6-8-15(9-7-12)17-11-13-4-3-5-14(10-13)16-2/h2*3-4,6-9,13-14H,5,10-11H2,1-2H3/t13-,14+;13-,14-/m00/s1
InChIKey NTZVDYZOJKESQT-JCQOKHLZSA-N
Mol Weight 496.77 g/mol
Molecular Formula C30H40O2S2
Exact Mass 496.246973 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9ObRmm5ILj4
Name 5-METHOXY-3-(PARA-TOLYLTHIOMETHYL)-CYCLOHEXENE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H40O2S2
InChI InChI=1S/2C15H20OS/c2*1-12-6-8-15(9-7-12)17-11-13-4-3-5-14(10-13)16-2/h2*3-4,6-9,13-14H,5,10-11H2,1-2H3/t13-,14+;13-,14-/m00/s1
InChIKey NTZVDYZOJKESQT-JCQOKHLZSA-N
Literature Reference Author D.S.CHEKMAREV,M.I.LAZAREVA,G.V.ZATONSKY,A.V.MASKAEV,R.CAPLE, W.SMIT
Literature Reference Citation J.ORG.CHEM.,67,7957(2002)
Literature Reference DOI 10.1021/jo0261202
Molecular Weight 496.766 g/mol
Solvent CDCl3
Source File Reference UWMS23713