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CANDIDALACTONE-METHYLESTER
SpectraBase Compound ID 9FvBhp4pc1o
InChI InChI=1S/C21H30O4/c1-7-20(4)11-14(17(22)24-6)21(5)13-9-8-10-19(2,3)16(13)18(23)25-15(21)12-20/h7,14-15H,1,8-12H2,2-6H3/t14-,15-,20+,21-/m0/s1
InChIKey DARRIGAMNMSITP-YJPXFSGGSA-N
Mol Weight 346.47 g/mol
Molecular Formula C21H30O4
Exact Mass 346.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DIAqhB4OA0G
Name CANDIDALACTONE-METHYLESTER
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H30O4
InChI InChI=1S/C21H30O4/c1-7-20(4)11-14(17(22)24-6)21(5)13-9-8-10-19(2,3)16(13)18(23)25-15(21)12-20/h7,14-15H,1,8-12H2,2-6H3/t14-,15-,20+,21-/m0/s1
InChIKey DARRIGAMNMSITP-YJPXFSGGSA-N
Literature Reference Author L.M.M.VALENTE,A.A.L.GUNATILAKA,G.G.I.KINGSTON,M.L.PATITUCCI, A.C.PINTO
Literature Reference Citation J.NAT.PROD.,60,478(1997)
Literature Reference DOI 10.1021/np960695a
Molecular Weight 346.467 g/mol
Solvent CDCl3
Source File Reference UWCP654