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PENICIDONE-A;(R,E)-5-(5,7-DIMETHOXY-3-OXO-1,3-DIHYDROISOBENZOFURAN-1-YL)-2-(PROP-1-ENYL)-PYRIDIN-4(1H)-ONE
SpectraBase Compound ID 8WetBNYBapk
InChI InChI=1S/C18H17NO5/c1-4-5-10-6-14(20)13(9-19-10)17-16-12(18(21)24-17)7-11(22-2)8-15(16)23-3/h4-9,17H,1-3H3,(H,19,20)/b5-4+/t17-/m0/s1
InChIKey VHRYRCYSKWAFFV-BDUNBXCCSA-N
Mol Weight 327.34 g/mol
Molecular Formula C18H17NO5
Exact Mass 327.110673 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6ggLCCLbMo4
Name PENICIDONE-A;(R,E)-5-(5,7-DIMETHOXY-3-OXO-1,3-DIHYDROISOBENZOFURAN-1-YL)-2-(PROP-1-ENYL)-PYRIDIN-4(1H)-ONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H17NO5
InChI InChI=1S/C18H17NO5/c1-4-5-10-6-14(20)13(9-19-10)17-16-12(18(21)24-17)7-11(22-2)8-15(16)23-3/h4-9,17H,1-3H3,(H,19,20)/b5-4+/t17-/m0/s1
InChIKey VHRYRCYSKWAFFV-BDUNBXCCSA-N
Literature Reference Author H.M.GE,Y.SHEN,C.H.ZHU,S.H.TAN,H.DING,Y.C.SONG,R.X.TAN
Literature Reference Citation PHYTOCHEM.,69,571(2008)
Literature Reference DOI 10.1016/j.phytochem.2007.07.014
Molecular Weight 327.337 g/mol
Sample ID 43404
Solvent DMSO-D6