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#13A;(2E,2'E)-5-[(TERT.-BUTYLDIMETHYLSILYL)-OXY-METHYL]-3-ETHYL-2-[(2-METHYL-(2,6,6-TRIMETHYLCYCLOHEX-1-EN-1-YL)-3-BUT-2-EN-1-ENYLIDENE]-4-METHYL-2,5-DIHYDROTH
SpectraBase Compound ID BiT2zgYo2i0
InChI InChI=1S/C28H48O3SSi/c1-12-23-22(4)26(19-31-33(10,11)27(5,6)7)32(29,30)25(23)18-20(2)15-16-24-21(3)14-13-17-28(24,8)9/h15,18,26H,12-14,16-17,19H2,1-11H3/b20-15+,25-18+/t26-/m0/s1
InChIKey CDZIHFSIHUNPME-OTGQUDKASA-N
Mol Weight 492.8 g/mol
Molecular Formula C28H48O3SSi
Exact Mass 492.309343 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JOfgU73JDqK
Name #13A;(2E,2'E)-5-[(TERT.-BUTYLDIMETHYLSILYL)-OXY-METHYL]-3-ETHYL-2-[(2-METHYL-(2,6,6-TRIMETHYLCYCLOHEX-1-EN-1-YL)-3-BUT-2-EN-1-ENYLIDENE]-4-METHYL-2,5-DIHYDROTH
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H48O3SSi
InChI InChI=1S/C28H48O3SSi/c1-12-23-22(4)26(19-31-33(10,11)27(5,6)7)32(29,30)25(23)18-20(2)15-16-24-21(3)14-13-17-28(24,8)9/h15,18,26H,12-14,16-17,19H2,1-11H3/b20-15+,25-18+/t26-/m0/s1
InChIKey CDZIHFSIHUNPME-OTGQUDKASA-N
Literature Reference Author J.A.SOUTO,C.S.LOPEZ,O.N.FAZA,R.ALVAREZ,A.R.D.LERA
Literature Reference Citation ORG.LETTERS,7,1565(2005)
Literature Reference DOI 10.1021/ol050240p
Molecular Weight 492.833 g/mol
Sample ID 62059
Solvent ACETONE-D6