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3-(3,4-DIMETHOXYPHENYL)-PROPENYL-3-(4-METHYLPHENYL)-ALLYLATE
SpectraBase Compound ID 3m5AMo5vDtN
InChI InChI=1S/C21H22O5/c1-23-18-10-6-16(7-11-18)9-13-21(22)26-14-4-5-17-8-12-19(24-2)20(15-17)25-3/h4-13,15H,14H2,1-3H3/b5-4+,13-9+
InChIKey KTFDPMBVVKIJNU-CCKNLQGCSA-N
Mol Weight 354.4 g/mol
Molecular Formula C21H22O5
Exact Mass 354.146724 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4DcA3QFsQFA
Name 3-(3,4-DIMETHOXYPHENYL)-PROPENYL-3-(4-METHYLPHENYL)-ALLYLATE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22O5
InChI InChI=1S/C21H22O5/c1-23-18-10-6-16(7-11-18)9-13-21(22)26-14-4-5-17-8-12-19(24-2)20(15-17)25-3/h4-13,15H,14H2,1-3H3/b5-4+,13-9+
InChIKey KTFDPMBVVKIJNU-CCKNLQGCSA-N
Literature Reference Author L.H.HU,H.B.ZOU,J.X.GONG,H.B.LI,L.X.YANG,W.CHENG,C.X.ZHOU,H.B AI,F.GUERITTE,Y.ZHAO
Literature Reference Citation J.NAT.PROD.,68,342(2005)
Literature Reference DOI 10.1021/np0496441
Molecular Weight 354.403 g/mol
Solvent CDCl3
Source File Reference UWMZ7666