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METHYL-2-OXO-POPULIFOLOATE;METHYL-(5R,8R,9S,10R)-2-OXO-ENT-3-CLERODEN-15-OATE
SpectraBase Compound ID HHCIZj6MQfF
InChI InChI=1S/C21H34O3/c1-14(11-19(23)24-6)7-9-20(4)15(2)8-10-21(5)16(3)12-17(22)13-18(20)21/h12,14-15,18H,7-11,13H2,1-6H3/t14?,15-,18-,20+,21+/m1/s1
InChIKey GTRRAFRWVKQVAX-DOFVKIEHSA-N
Mol Weight 334.5 g/mol
Molecular Formula C21H34O3
Exact Mass 334.250795 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IxJzPPXoNUd
Name METHYL-2-OXO-POPULIFOLOATE;METHYL-(5R,8R,9S,10R)-2-OXO-ENT-3-CLERODEN-15-OATE
Compound Number 47
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H34O3
InChI InChI=1S/C21H34O3/c1-14(11-19(23)24-6)7-9-20(4)15(2)8-10-21(5)16(3)12-17(22)13-18(20)21/h12,14-15,18H,7-11,13H2,1-6H3/t14?,15-,18-,20+,21+/m1/s1
InChIKey GTRRAFRWVKQVAX-DOFVKIEHSA-N
Literature Reference Author A.G.PACHECO,P.M.DEOLIVEIRA,D.PILO-VELOSO,A.F.D.C.ALCANTARA
Literature Reference Citation MOLECULES,14,1245(2009)
Literature Reference DOI 10.3390/molecules14031245
Molecular Weight 334.499 g/mol
Sample ID 69412
Solvent CDCl3