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CANADINIC_ACID
SpectraBase Compound ID LASgTCpwVB9
InChI InChI=1S/C21H23NO6/c1-22-7-6-12-9-17-18(28-11-27-17)10-14(12)15(22)8-13-4-5-16(25-2)20(26-3)19(13)21(23)24/h4-5,9-10,15H,6-8,11H2,1-3H3,(H,23,24)
InChIKey OBMCYABEWGVSQB-UHFFFAOYSA-N
Mol Weight 385.42 g/mol
Molecular Formula C21H23NO6
Exact Mass 385.152537 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EPm04m1UDuq
Name CANADINIC_ACID
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H23NO6
InChI InChI=1S/C21H23NO6/c1-22-7-6-12-9-17-18(28-11-27-17)10-14(12)15(22)8-13-4-5-16(25-2)20(26-3)19(13)21(23)24/h4-5,9-10,15H,6-8,11H2,1-3H3,(H,23,24)
InChIKey OBMCYABEWGVSQB-UHFFFAOYSA-N
Literature Reference Author C.GALEFFI,M.F.COMETA,L.TOMASSINI,M.NICOLETTI
Literature Reference Citation PLANTA.MED.,63,194(1997)
Literature Reference DOI 10.1055/s-2006-957649
Molecular Weight 385.417 g/mol
Solvent CDCl3
Source File Reference UIAP920