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(3'-R)-5-HYDROXY-3-(3'-HYDROXYBUTYL)-ISOBENZOFURAN-1-(3H)-ONE
SpectraBase Compound ID AOBqx3FWKW5
InChI InChI=1S/C12H14O4/c1-7(13)2-5-11-10-6-8(14)3-4-9(10)12(15)16-11/h3-4,6-7,11,13-14H,2,5H2,1H3/t7-,11?/m1/s1
InChIKey IMUDJPJBCPARAW-DKSCNQEISA-N
Mol Weight 222.24 g/mol
Molecular Formula C12H14O4
Exact Mass 222.089209 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 47euygjhVeQ
Name (3'-R)-5-HYDROXY-3-(3'-HYDROXYBUTYL)-ISOBENZOFURAN-1-(3H)-ONE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H14O4
InChI InChI=1S/C12H14O4/c1-7(13)2-5-11-10-6-8(14)3-4-9(10)12(15)16-11/h3-4,6-7,11,13-14H,2,5H2,1H3/t7-,11?/m1/s1
InChIKey IMUDJPJBCPARAW-DKSCNQEISA-N
Literature Reference Author S.D.MARINO,F.GALA,N.BORBONE,F.ZOLLO,S.VITALINI,F.VISIOLI,M.I ORIZZI
Literature Reference Citation PHYTOCHEM.,68,1805(2007)
Literature Reference DOI 10.1016/j.phytochem.2007.03.029
Molecular Weight 222.241 g/mol
Sample ID 42705
Solvent CD3OD