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TRANS-2-((E)-2'-METHYLHEXA-3',5'-DIEN-2'-YL)-3-(PARA-TOLYLTHIO)-TETRAHYDROPYRANE
SpectraBase Compound ID CPJCXTLdbQP
InChI InChI=1S/C19H26OS/c1-5-6-13-19(3,4)18-17(8-7-14-20-18)21-16-11-9-15(2)10-12-16/h5-6,9-13,17-18H,1,7-8,14H2,2-4H3/b13-6+/t17-,18-/m0/s1
InChIKey CYHKSKOPNFZHPY-VQERQSFQSA-N
Mol Weight 302.48 g/mol
Molecular Formula C19H26OS
Exact Mass 302.170437 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1RAUrV17HM
Name TRANS-2-((E)-2'-METHYLHEXA-3',5'-DIEN-2'-YL)-3-(PARA-TOLYLTHIO)-TETRAHYDROPYRANE
Compound Number 30
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H26OS
InChI InChI=1S/C19H26OS/c1-5-6-13-19(3,4)18-17(8-7-14-20-18)21-16-11-9-15(2)10-12-16/h5-6,9-13,17-18H,1,7-8,14H2,2-4H3/b13-6+/t17-,18-/m0/s1
InChIKey CYHKSKOPNFZHPY-VQERQSFQSA-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 302.475 g/mol
Solvent CDCl3
Source File Reference UWMS23722