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ETHYL_3-O-ACETYLNIDULOIC_ACID;ETHYL-(S)-3-ACETOXY-5-(PARA-HYDROXYPHENYL)-PENTANOATE
SpectraBase Compound ID An4G9df5TI3
InChI InChI=1S/C15H20O5/c1-3-19-15(18)10-14(20-11(2)16)9-6-12-4-7-13(17)8-5-12/h4-5,7-8,14,17H,3,6,9-10H2,1-2H3/t14-/m0/s1
InChIKey KIHREBPBKASOMN-AWEZNQCLSA-N
Mol Weight 280.32 g/mol
Molecular Formula C15H20O5
Exact Mass 280.131074 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 16OF8fo8eZa
Name ETHYL_3-O-ACETYLNIDULOIC_ACID;ETHYL-(S)-3-ACETOXY-5-(PARA-HYDROXYPHENYL)-PENTANOATE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H20O5
InChI InChI=1S/C15H20O5/c1-3-19-15(18)10-14(20-11(2)16)9-6-12-4-7-13(17)8-5-12/h4-5,7-8,14,17H,3,6,9-10H2,1-2H3/t14-/m0/s1
InChIKey KIHREBPBKASOMN-AWEZNQCLSA-N
Literature Reference Author P.L.WU,Y.L.HSU,C.W.ZAO,A.G.DAMU,T.S.WU
Literature Reference Citation J.NAT.PROD.,68,1180(2005)
Literature Reference DOI 10.1021/np050060o
Molecular Weight 280.321 g/mol
Solvent CDCl3
Source File Reference UWMZ13412