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3'-(4''-HYDROXY-3'',5''-DIMETHOXYPHENYL)-PROPYLBENZOATE
SpectraBase Compound ID 6Oj35gT2tZC
InChI InChI=1S/C18H20O5/c1-21-15-11-13(12-16(22-2)17(15)19)7-6-10-23-18(20)14-8-4-3-5-9-14/h3-5,8-9,11-12,19H,6-7,10H2,1-2H3
InChIKey COFCMLKODGVUBA-UHFFFAOYSA-N
Mol Weight 316.35 g/mol
Molecular Formula C18H20O5
Exact Mass 316.131074 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FLGNRXUxCXh
Name 3'-(4''-HYDROXY-3'',5''-DIMETHOXYPHENYL)-PROPYLBENZOATE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H20O5
InChI InChI=1S/C18H20O5/c1-21-15-11-13(12-16(22-2)17(15)19)7-6-10-23-18(20)14-8-4-3-5-9-14/h3-5,8-9,11-12,19H,6-7,10H2,1-2H3
InChIKey COFCMLKODGVUBA-UHFFFAOYSA-N
Literature Reference Author S.ATHIKOMKULCHAI,H.PRAWAT,N.THASANA,N.RUANGRUNGSI,S.RUCHIRAW AT
Literature Reference Citation CHEM.PHARM.BULL.,54,262(2006)
Literature Reference DOI 10.1248/cpb.54.262
Molecular Weight 316.354 g/mol
Sample ID 36996
Solvent CDCl3