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COCCINEONE-E;9,10-DIMETHOXY-11,12A-DIHYDROXY-ROTENOID
SpectraBase Compound ID 1YClwBzlNk1
InChI InChI=1S/C18H16O7/c1-22-12-7-11-14(15(19)16(12)23-2)17(20)18(21)9-5-3-4-6-10(9)24-8-13(18)25-11/h3-7,13,19,21H,8H2,1-2H3/t13-,18+/m0/s1
InChIKey KDJHEZRWCNFWGE-SCLBCKFNSA-N
Mol Weight 344.32 g/mol
Molecular Formula C18H16O7
Exact Mass 344.089603 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jn0FUJfYZrR
Name COCCINEONE-E;9,10-DIMETHOXY-11,12A-DIHYDROXY-ROTENOID
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H16O7
InChI InChI=1S/C18H16O7/c1-22-12-7-11-14(15(19)16(12)23-2)17(20)18(21)9-5-3-4-6-10(9)24-8-13(18)25-11/h3-7,13,19,21H,8H2,1-2H3/t13-,18+/m0/s1
InChIKey KDJHEZRWCNFWGE-SCLBCKFNSA-N
Literature Reference Author A.S.SANTOS,L.C.CAETANO,A.E.G.SANTANA
Literature Reference Citation PHYTOCHEM.,49,255(1998)
Literature Reference DOI 10.1016/S0031-9422(97)01040-6
Molecular Weight 344.321 g/mol
Solvent CDCl3
Source File Reference UWLU114