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TRANS-2-((E)-2',5'-DIMETHYLHEXA-3',5'-DIEN-2'-YL)-3-(PARA-TOLYLTHIO)-TETRAHYDROPYRANE
SpectraBase Compound ID 7D0MX8x0euq
InChI InChI=1S/C20H28OS/c1-15(2)12-13-20(4,5)19-18(7-6-14-21-19)22-17-10-8-16(3)9-11-17/h8-13,18-19H,1,6-7,14H2,2-5H3/b13-12+/t18-,19-/m0/s1
InChIKey UAWLWRBOPPYXDK-PKMDAXGDSA-N
Mol Weight 316.5 g/mol
Molecular Formula C20H28OS
Exact Mass 316.186087 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4MHeKovUpOl
Name TRANS-2-((E)-2',5'-DIMETHYLHEXA-3',5'-DIEN-2'-YL)-3-(PARA-TOLYLTHIO)-TETRAHYDROPYRANE
Compound Number 31
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28OS
InChI InChI=1S/C20H28OS/c1-15(2)12-13-20(4,5)19-18(7-6-14-21-19)22-17-10-8-16(3)9-11-17/h8-13,18-19H,1,6-7,14H2,2-5H3/b13-12+/t18-,19-/m0/s1
InChIKey UAWLWRBOPPYXDK-PKMDAXGDSA-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 316.502 g/mol
Solvent CDCl3
Source File Reference UWMS23723