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(2E,4E,6E,8E)-9-[2-[(1E,3E)-5-keto-5-methoxy-penta-1,3-dienyl]phenyl]nona-2,4,6,8-tetraenoic acid methyl ester
SpectraBase Compound ID 6PBPCfniqt2
InChI InChI=1S/C22H22O4/c1-25-21(23)17-8-6-4-3-5-7-13-19-14-9-10-15-20(19)16-11-12-18-22(24)26-2/h3-18H,1-2H3/b5-3+,6-4+,13-7+,16-11+,17-8+,18-12+
InChIKey NSMLLNYPFBHOCC-IQFZKPHJSA-N
Mol Weight 350.41 g/mol
Molecular Formula C22H22O4
Exact Mass 350.151809 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JS60KP7n1UR
Name (2E,4E,6E,8E)-9-[2-[(1E,3E)-5-keto-5-methoxy-penta-1,3-dienyl]phenyl]nona-2,4,6,8-tetraenoic acid methyl ester
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22O4
InChI InChI=1S/C22H22O4/c1-25-21(23)17-8-6-4-3-5-7-13-19-14-9-10-15-20(19)16-11-12-18-22(24)26-2/h3-18H,1-2H3/b5-3+,6-4+,13-7+,16-11+,17-8+,18-12+
InChIKey NSMLLNYPFBHOCC-IQFZKPHJSA-N
Literature Reference Author S.C.WENZEL,H.B.BODE
Literature Reference Citation J.NAT.PROD.,67,1631(2004)
Literature Reference DOI 10.1021/np049852t
Molecular Weight 350.414 g/mol
Solvent CD2Cl2
Source File Reference UWMZ8164