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(3R)-6,8-DIHYDROXY-3-(6-OXOUNDECYL)-3,4-DIHYDROISOCOUMARIN
SpectraBase Compound ID LhGg8jlVMm9
InChI InChI=1S/C20H28O5/c1-2-3-5-8-15(21)9-6-4-7-10-17-12-14-11-16(22)13-18(23)19(14)20(24)25-17/h11,13,17,22-23H,2-10,12H2,1H3/t17-/m1/s1
InChIKey MHNBPSGXKPGDKQ-QGZVFWFLSA-N
Mol Weight 348.44 g/mol
Molecular Formula C20H28O5
Exact Mass 348.193674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HY4p1KbCF9M
Name (3R)-6,8-DIHYDROXY-3-(6-OXOUNDECYL)-3,4-DIHYDROISOCOUMARIN
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28O5
InChI InChI=1S/C20H28O5/c1-2-3-5-8-15(21)9-6-4-7-10-17-12-14-11-16(22)13-18(23)19(14)20(24)25-17/h11,13,17,22-23H,2-10,12H2,1H3/t17-/m1/s1
InChIKey MHNBPSGXKPGDKQ-QGZVFWFLSA-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 348.439 g/mol
Solvent CDCl3
Source File Reference UWVN29488