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1-(1,3-DIHYDRO-4-HYDROXY-1-ISOBENZOFURANYL)-BUTAN-2,3-DIOL
SpectraBase Compound ID JPJTNXoqred
InChI InChI=1S/C12H16O4/c1-7(13)11(15)5-12-8-3-2-4-10(14)9(8)6-16-12/h2-4,7,11-15H,5-6H2,1H3
InChIKey VWNBIHJYLBWFKS-UHFFFAOYSA-N
Mol Weight 224.26 g/mol
Molecular Formula C12H16O4
Exact Mass 224.104859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1XrlFJO3uC8
Name 1-(1,3-DIHYDRO-4-HYDROXY-1-ISOBENZOFURANYL)-BUTAN-2,3-DIOL
Compound Number 7A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H16O4
InChI InChI=1S/C12H16O4/c1-7(13)11(15)5-12-8-3-2-4-10(14)9(8)6-16-12/h2-4,7,11-15H,5-6H2,1H3
InChIKey VWNBIHJYLBWFKS-UHFFFAOYSA-N
Literature Reference Author U.HOELLER,J.B.GLOER,D.T.WICKLOW
Literature Reference Citation J.NAT.PROD.,65,876(2002)
Literature Reference DOI 10.1021/np020097y
Molecular Weight 224.257 g/mol
Solvent CD3OD
Source File Reference UWSI6059