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METHYL-(3R*,6S*,Z)-4,6-DIETHYL-8-METHYL-3,6-EPIDIOXYDODECA-4-ENOATE
SpectraBase Compound ID FqJ60PA45A1
InChI InChI=1S/C18H32O4/c1-6-9-10-14(4)12-18(8-3)13-15(7-2)16(21-22-18)11-17(19)20-5/h13-14,16H,6-12H2,1-5H3/t14-,16-,18+/m1/s1
InChIKey NADAFJAMWAJIRR-KYJSFNMBSA-N
Mol Weight 312.5 g/mol
Molecular Formula C18H32O4
Exact Mass 312.23006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BDO93tvlYIY
Name METHYL-(3R*,6S*,Z)-4,6-DIETHYL-8-METHYL-3,6-EPIDIOXYDODECA-4-ENOATE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H32O4
InChI InChI=1S/C18H32O4/c1-6-9-10-14(4)12-18(8-3)13-15(7-2)16(21-22-18)11-17(19)20-5/h13-14,16H,6-12H2,1-5H3/t14-,16-,18+/m1/s1
InChIKey NADAFJAMWAJIRR-KYJSFNMBSA-N
Literature Reference Author M.HOLZWARTH,J.M.TRENDEL,P.ALBRECHT,A.MAIER,W.MICHAELIS
Literature Reference Citation J.NAT.PROD.,68,759(2005)
Literature Reference DOI 10.1021/np049665v
Molecular Weight 312.450 g/mol
Solvent CDCl3