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3-[((4E,6E,8E)-DODECA-4,6,8-TRIENYL)-OXY]-2-(4-HYDROXYBENZOYL)-PROPAN-1-OL;1-[((4E,6E,8E)-DODECA-4,6,8-TRIENYL)-OXY]-3-HYDROXYPROPAN-2-YL-4-HYDROXYBENZOATE

View entire compound with spectra: 2 NMR

3-[((4E,6E,8E)-DODECA-4,6,8-TRIENYL)-OXY]-2-(4-HYDROXYBENZOYL)-PROPAN-1-OL;1-[((4E,6E,8E)-DODECA-4,6,8-TRIENYL)-OXY]-3-HYDROXYPROPAN-2-YL-4-HYDROXYBENZOATE
SpectraBase Compound ID 6CGmv8qHPHQ
InChI InChI=1S/C22H30O5/c1-2-3-4-5-6-7-8-9-10-11-16-26-18-21(17-23)27-22(25)19-12-14-20(24)15-13-19/h4-9,12-15,21,23-24H,2-3,10-11,16-18H2,1H3/b5-4+,7-6+,9-8+
InChIKey HDFSCPGSKMWCOJ-ZAJAATJQSA-N
Mol Weight 374.48 g/mol
Molecular Formula C22H30O5
Exact Mass 374.209324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5PqSgJedTK9
Name 3-[((4E,6E,8E)-DODECA-4,6,8-TRIENYL)-OXY]-2-(4-HYDROXYBENZOYL)-PROPAN-1-OL;1-[((4E,6E,8E)-DODECA-4,6,8-TRIENYL)-OXY]-3-HYDROXYPROPAN-2-YL-4-HYDROXYBENZOATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H30O5
InChI InChI=1S/C22H30O5/c1-2-3-4-5-6-7-8-9-10-11-16-26-18-21(17-23)27-22(25)19-12-14-20(24)15-13-19/h4-9,12-15,21,23-24H,2-3,10-11,16-18H2,1H3/b5-4+,7-6+,9-8+
InChIKey HDFSCPGSKMWCOJ-ZAJAATJQSA-N
Literature Reference Author G.GUELLA,I.MANCINI,F.PIETRA
Literature Reference Citation HELV.CHIM.ACTA,72,1121(1989)
Literature Reference DOI 10.1002/hlca.19890720530
Molecular Weight 374.477 g/mol
Solvent CD3OD
Source File Reference UWED12332