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N-(3-OXO-1-BUTENYL)-RENIERONE
SpectraBase Compound ID IfOJ7C6SSd4
InChI InChI=1S/C21H23NO6/c1-6-12(2)21(26)28-11-16-17-15(8-10-22(16)9-7-13(3)23)18(24)14(4)20(27-5)19(17)25/h6-10,16H,11H2,1-5H3/b9-7+,12-6-
InChIKey PUTNBDBETDXSKU-OHFWFHSGSA-N
Mol Weight 385.42 g/mol
Molecular Formula C21H23NO6
Exact Mass 385.152537 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HiiowQ6Sr6G
Name N-(3-OXO-1-BUTENYL)-RENIERONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H23NO6
InChI InChI=1S/C21H23NO6/c1-6-12(2)21(26)28-11-16-17-15(8-10-22(16)9-7-13(3)23)18(24)14(4)20(27-5)19(17)25/h6-10,16H,11H2,1-5H3/b9-7+,12-6-
InChIKey PUTNBDBETDXSKU-OHFWFHSGSA-N
Literature Reference Author R.A.EDRADA,P.PROKSCH,V.WARY,R.CHRIST,L.WITTE,R.W.M.VANSOEST
Literature Reference Citation J.NAT.PROD.,59,973(1996)
Literature Reference DOI 10.1021/np960258w
Molecular Weight 385.417 g/mol
Solvent CD2Cl2
Source File Reference UWVP755