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(2'R,12'S)-5-(2-ACETOXY-12-HYDROXYTRIDECYL)-RESORCINOL;
SpectraBase Compound ID 4zEbUzFDQXU
InChI InChI=1S/C21H34O5/c1-16(22)10-8-6-4-3-5-7-9-11-21(26-17(2)23)14-18-12-19(24)15-20(25)13-18/h12-13,15-16,21-22,24-25H,3-11,14H2,1-2H3/t16-,21-/m1/s1
InChIKey XPDBYTRMUWQPTF-IIBYNOLFSA-N
Mol Weight 366.5 g/mol
Molecular Formula C21H34O5
Exact Mass 366.240624 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FGhdbBvqJiz
Name (2'R,12'S)-5-(2-ACETOXY-12-HYDROXYTRIDECYL)-RESORCINOL;
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H34O5
InChI InChI=1S/C21H34O5/c1-16(22)10-8-6-4-3-5-7-9-11-21(26-17(2)23)14-18-12-19(24)15-20(25)13-18/h12-13,15-16,21-22,24-25H,3-11,14H2,1-2H3/t16-,21-/m1/s1
InChIKey XPDBYTRMUWQPTF-IIBYNOLFSA-N
Literature Reference Author A.F.BARRERO,J.F.SANCHEZ,F.REYES,I.RODRIGUEZ
Literature Reference Citation PHYTOCHEM.,30,641(1991)
Literature Reference DOI 10.1016/0031-9422(91)83743-5
Molecular Weight 366.498 g/mol
Solvent CDCl3
Source File Reference UWLU32323