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2-[(3S,4R,6S)-6-[(E,4S)-2,4-diethyloct-1-enyl]-4,6-diethyl-dioxan-3-yl]acetic acid methyl ester
SpectraBase Compound ID Dyh1sJZwcqR
InChI InChI=1S/C23H42O4/c1-7-12-13-18(8-2)14-19(9-3)16-23(11-5)17-20(10-4)21(26-27-23)15-22(24)25-6/h16,18,20-21H,7-15,17H2,1-6H3/b19-16+/t18-,20+,21-,23+/m0/s1
InChIKey MQOXHEXIFJRZSO-NEVNYHIDSA-N
Mol Weight 382.6 g/mol
Molecular Formula C23H42O4
Exact Mass 382.30831 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LPIYOiZdIR3
Name 2-[(3S,4R,6S)-6-[(E,4S)-2,4-diethyloct-1-enyl]-4,6-diethyl-dioxan-3-yl]acetic acid methyl ester
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H42O4
InChI InChI=1S/C23H42O4/c1-7-12-13-18(8-2)14-19(9-3)16-23(11-5)17-20(10-4)21(26-27-23)15-22(24)25-6/h16,18,20-21H,7-15,17H2,1-6H3/b19-16+/t18-,20+,21-,23+/m0/s1
InChIKey MQOXHEXIFJRZSO-NEVNYHIDSA-N
Literature Reference Author A.FONTANA,M.ISHIBASHI,H.SHIGEMORI,J.KOBAYASHI
Literature Reference Citation J.NAT.PROD.,61,1427(1998)
Literature Reference DOI 10.1021/np980187w
Molecular Weight 382.584 g/mol
Solvent CDCl3
Source File Reference UWCS19586