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17-CARBOXYGRINDELIC ACID
SpectraBase Compound ID EPCMCWYJXUX
InChI InChI=1S/C20H30O5/c1-17(2)8-5-9-19(4)14(17)7-6-13(16(23)24)20(19)11-10-18(3,25-20)12-15(21)22/h6,14H,5,7-12H2,1-4H3,(H,21,22)(H,23,24)/t14-,18+,19-,20+/m0/s1
InChIKey VDAJUTSZDRZBPC-WEFJBSGNSA-N
Mol Weight 350.46 g/mol
Molecular Formula C20H30O5
Exact Mass 350.209324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E3aAcd4tFQt
Name 17-CARBOXYGRINDELIC-ACID
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H30O5
InChI InChI=1S/C20H30O5/c1-17(2)8-5-9-19(4)14(17)7-6-13(16(23)24)20(19)11-10-18(3,25-20)12-15(21)22/h6,14H,5,7-12H2,1-4H3,(H,21,22)(H,23,24)/t14-,18+,19-,20+/m0/s1
InChIKey VDAJUTSZDRZBPC-WEFJBSGNSA-N
Literature Reference Author M.A.MENELAOU,J.D.WEIDENHAMER,G.B.WILLIAMSON,F.R.FRONCZEK,H.D .FISCHER,L.QUIJANO,N
Literature Reference Citation PHYTOCHEM.,34,97(1993)
Literature Reference DOI 10.1016/S0031-9422(00)90789-1
Molecular Weight 350.455 g/mol
Solvent CDCl3
Source File Reference UWLU7124