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3'-(4'''-BROMOPHENYL)-PROPANYL_3-(3''-HYDROXY-4''-METHOXYPHENYL)-PROPANOATE
SpectraBase Compound ID Lk4zx23VdKp
InChI InChI=1S/C19H21BrO4/c1-23-18-10-6-15(13-17(18)21)7-11-19(22)24-12-2-3-14-4-8-16(20)9-5-14/h4-6,8-10,13,21H,2-3,7,11-12H2,1H3
InChIKey JDKSRDPCOQCCRP-UHFFFAOYSA-N
Mol Weight 393.28 g/mol
Molecular Formula C19H21BrO4
Exact Mass 392.062322 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LDq3rlOAMnu
Name 3'-(4'''-BROMOPHENYL)-PROPANYL_3-(3''-HYDROXY-4''-METHOXYPHENYL)-PROPANOATE
Compound Number 40
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H21BrO4
InChI InChI=1S/C19H21BrO4/c1-23-18-10-6-15(13-17(18)21)7-11-19(22)24-12-2-3-14-4-8-16(20)9-5-14/h4-6,8-10,13,21H,2-3,7,11-12H2,1H3
InChIKey JDKSRDPCOQCCRP-UHFFFAOYSA-N
Literature Reference Author G.R.PETTIT,P.D.QUISTORF,J.A.FRY,D.L.HERALD,E.HAMEL,J.C.CHAPU IS
Literature Reference Citation J.NAT.PROD.,72,876(2009)
Literature Reference DOI 10.1021/np800635h
Molecular Weight 393.277 g/mol
Sample ID 32564
Solvent CDCl3