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(3R)-8-HYDROXY-6-METHOXY-3-(6-HYDROXYUNDECYL)-3,4-DIHYDROISOCOUMARIN
SpectraBase Compound ID JW3TrhLIYZ1
InChI InChI=1S/C21H32O5/c1-3-4-6-9-16(22)10-7-5-8-11-17-12-15-13-18(25-2)14-19(23)20(15)21(24)26-17/h13-14,16-17,22-23H,3-12H2,1-2H3/t16?,17-/m1/s1
InChIKey LYFHIUXSMZPGHC-ZYMOGRSISA-N
Mol Weight 364.5 g/mol
Molecular Formula C21H32O5
Exact Mass 364.224974 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6HqYrEyN8Jj
Name (3R)-8-HYDROXY-6-METHOXY-3-(6-HYDROXYUNDECYL)-3,4-DIHYDROISOCOUMARIN
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H32O5
InChI InChI=1S/C21H32O5/c1-3-4-6-9-16(22)10-7-5-8-11-17-12-15-13-18(25-2)14-19(23)20(15)21(24)26-17/h13-14,16-17,22-23H,3-12H2,1-2H3/t16?,17-/m1/s1
InChIKey LYFHIUXSMZPGHC-ZYMOGRSISA-N
Literature Reference Author A.S.FELICIANO,J.M.M.D.CORRAL,L.M.CANEDO,M.MEDARDE
Literature Reference Citation PHYTOCHEM.,29,945(1990)
Literature Reference DOI 10.1016/0031-9422(90)80052-I
Molecular Weight 364.482 g/mol
Solvent CDCl3
Source File Reference UWVN29491