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3R-(2R-HYDROXYPROPYL)-8-HYDROXY-7-METHYL-3,4-DIHYDRO-ISOCOUMARINE
SpectraBase Compound ID cL1J1HpNrR
InChI InChI=1S/C13H16O4/c1-7-3-4-9-6-10(5-8(2)14)17-13(16)11(9)12(7)15/h3-4,8,10,14-15H,5-6H2,1-2H3/t8-,10+/m1/s1
InChIKey WDCHVRICDGHOKM-SCZZXKLOSA-N
Mol Weight 236.27 g/mol
Molecular Formula C13H16O4
Exact Mass 236.104859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3VpmXvZCgTK
Name 3R-(2R-HYDROXYPROPYL)-8-HYDROXY-7-METHYL-3,4-DIHYDRO-ISOCOUMARINE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16O4
InChI InChI=1S/C13H16O4/c1-7-3-4-9-6-10(5-8(2)14)17-13(16)11(9)12(7)15/h3-4,8,10,14-15H,5-6H2,1-2H3/t8-,10+/m1/s1
InChIKey WDCHVRICDGHOKM-SCZZXKLOSA-N
Literature Reference Author Z.Y.ZHOU,R.LIU,M.Y.JIANG,L.ZHANG,Y.NIU,Y.C.ZHU,Z.J.DONG,J.K. LIU
Literature Reference Citation CHEM.PHARM.BULL.,57,975(2009)
Literature Reference DOI 10.1248/cpb.57.975
Molecular Weight 236.268 g/mol
Sample ID 2903
Solvent CD3OD