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2-[(3S,6R)-6-[(6E,8E)-DECA-6,8-DIENYL]-6-METHOXY-4-METHYL-1,2-DIOXAN-3-YL]-ACETIC-ACID
SpectraBase Compound ID CSrrqhg6XoN
InChI InChI=1S/C17H28O5/c1-3-4-5-6-7-8-9-10-12-17(20-2)13-11-15(21-22-17)14-16(18)19/h3-6,15H,7-14H2,1-2H3,(H,18,19)/b4-3+,6-5+/t15-,17+/m0/s1
InChIKey YQNUVMLWQJAAOZ-IUIONDDBSA-N
Mol Weight 312.41 g/mol
Molecular Formula C17H28O5
Exact Mass 312.193674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8T70MPAOFFD
Name 2-[(3S,6R)-6-[(6E,8E)-DECA-6,8-DIENYL]-6-METHOXY-4-METHYL-1,2-DIOXAN-3-YL]-ACETIC-ACID
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H28O5
InChI InChI=1S/C17H28O5/c1-3-4-5-6-7-8-9-10-12-17(20-2)13-11-15(21-22-17)14-16(18)19/h3-6,15H,7-14H2,1-2H3,(H,18,19)/b4-3+,6-5+/t15-,17+/m0/s1
InChIKey YQNUVMLWQJAAOZ-IUIONDDBSA-N
Literature Reference Author J.S.OH,B.S.HWANG,O.H.KANG,D.Y.KWON,J.R.RHO
Literature Reference Citation MAR.DRUGS,11,4407(2013)
Literature Reference DOI 10.3390/md11114407
Molecular Weight 312.406 g/mol
Source File Reference UWBT6496