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methyl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate
SpectraBase Compound ID Gzp4tNGs2sF
InChI InChI=1S/C21H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h4-5,7-8,10-11,13-14,16-17H,3,6,9,12,15,18-20H2,1-2H3/b5-4-,8-7-,11-10-,14-13-,17-16-
InChIKey QWDCYFDDFPWISL-JEBPEJKESA-N
Mol Weight 316.5 g/mol
Molecular Formula C21H32O2
Exact Mass 316.24023 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8kF45BNSqt7
Name methyl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate
Compound Number 33
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H32O2
InChI InChI=1S/C21H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h4-5,7-8,10-11,13-14,16-17H,3,6,9,12,15,18-20H2,1-2H3/b5-4-,8-7-,11-10-,14-13-,17-16-
InChIKey QWDCYFDDFPWISL-JEBPEJKESA-N
Literature Reference Author J.SANDRI,T.SOTO,J.L.GRAS,J.VIALA
Literature Reference Citation MAGN.RES.CHEM.,35,785(1997)
Literature Reference DOI 10.1002/(sici)1097-458x(199711)35:11<785::aid-omr178>3.0.co;2-f
Molecular Weight 316.484 g/mol
Solvent CDCl3
Source File Reference UWCP3659