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TOONIN-C;(7S,8R)-7,8-DIHYDRO-8-(HYDROXYMETHYL)-3'-METHOXY-7-[3,4-(METHYLENEDIOXY)-PHENYL]-BENZOFURAN-1'-CARBOXYLIC-ACID-METHYLESTER

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TOONIN-C;(7S,8R)-7,8-DIHYDRO-8-(HYDROXYMETHYL)-3'-METHOXY-7-[3,4-(METHYLENEDIOXY)-PHENYL]-BENZOFURAN-1'-CARBOXYLIC-ACID-METHYLESTER
SpectraBase Compound ID F8Vmd4uIRzH
InChI InChI=1S/C19H18O7/c1-22-16-7-11(19(21)23-2)5-12-13(8-20)17(26-18(12)16)10-3-4-14-15(6-10)25-9-24-14/h3-7,13,17,20H,8-9H2,1-2H3/t13-,17+/m1/s1
InChIKey VRLLQDATJITICB-DYVFJYSZSA-N
Mol Weight 358.35 g/mol
Molecular Formula C19H18O7
Exact Mass 358.105253 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IH71oAvtlYw
Name TOONIN-C;(7S,8R)-7,8-DIHYDRO-8-(HYDROXYMETHYL)-3'-METHOXY-7-[3,4-(METHYLENEDIOXY)-PHENYL]-BENZOFURAN-1'-CARBOXYLIC-ACID-METHYLESTER
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H18O7
InChI InChI=1S/C19H18O7/c1-22-16-7-11(19(21)23-2)5-12-13(8-20)17(26-18(12)16)10-3-4-14-15(6-10)25-9-24-14/h3-7,13,17,20H,8-9H2,1-2H3/t13-,17+/m1/s1
InChIKey VRLLQDATJITICB-DYVFJYSZSA-N
Literature Reference Author X.J.DONG,Y.F.ZHU,G.H.BAO,F.L.HU,G.W.QIN
Literature Reference Citation MOLECULES,18,2840(2013)
Literature Reference DOI 10.3390/molecules18032840
Molecular Weight 358.348 g/mol
Solvent DMSO-D6
Source File Reference UWBT8924