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2-[2-hydroxy-2-[(5R)-5-[(1R,2E)-1-(2-methoxyethoxymethoxy)penta-2,4-dienyl]-2,6,6-trimethyl-1-cyclohexenyl]ethyl]acrylic acid ethyl ester

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2-[2-hydroxy-2-[(5R)-5-[(1R,2E)-1-(2-methoxyethoxymethoxy)penta-2,4-dienyl]-2,6,6-trimethyl-1-cyclohexenyl]ethyl]acrylic acid ethyl ester
SpectraBase Compound ID 3YQExmmEFvq
InChI InChI=1S/C25H40O6/c1-8-10-11-22(31-17-29-15-14-28-7)20-13-12-18(3)23(25(20,5)6)21(26)16-19(4)24(27)30-9-2/h8,10-11,20-22,26H,1,4,9,12-17H2,2-3,5-7H3/b11-10+/t20-,21?,22+/m0/s1
InChIKey NXPLTSNPNZPRDV-LIYSAXMKSA-N
Mol Weight 436.6 g/mol
Molecular Formula C25H40O6
Exact Mass 436.282489 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JLgqJd37itD
Name 2-[2-hydroxy-2-[(5R)-5-[(1R,2E)-1-(2-methoxyethoxymethoxy)penta-2,4-dienyl]-2,6,6-trimethyl-1-cyclohexenyl]ethyl]acrylic acid ethyl ester
Compound Number 49
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H40O6
InChI InChI=1S/C25H40O6/c1-8-10-11-22(31-17-29-15-14-28-7)20-13-12-18(3)23(25(20,5)6)21(26)16-19(4)24(27)30-9-2/h8,10-11,20-22,26H,1,4,9,12-17H2,2-3,5-7H3/b11-10+/t20-,21?,22+/m0/s1
InChIKey NXPLTSNPNZPRDV-LIYSAXMKSA-N
Literature Reference Author F.RICHTER,M.BAUER,C.PEREZ,C.MAICHLE-MOESSMER,M.E.MAIER
Literature Reference Citation J.ORG.CHEM.,67,2474(2002)
Literature Reference DOI 10.1021/jo016116a
Molecular Weight 436.589 g/mol
Solvent CDCl3
Source File Reference UWMS23427