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3-(2,4-Dibenzoxyphenyl)propionic acid 3-methylbut-2-enyl ester

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3-(2,4-Dibenzoxyphenyl)propionic acid 3-methylbut-2-enyl ester
SpectraBase Compound ID 4p3pFM6qWCC
InChI InChI=1S/C28H30O4/c1-22(2)17-18-30-28(29)16-14-25-13-15-26(31-20-23-9-5-3-6-10-23)19-27(25)32-21-24-11-7-4-8-12-24/h3-13,15,17,19H,14,16,18,20-21H2,1-2H3
InChIKey FSBWBCQWIQQTJB-UHFFFAOYSA-N
Mol Weight 430.54 g/mol
Molecular Formula C28H30O4
Exact Mass 430.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CJYg2tQOKoy
Name 3-(2,4-Dibenzoxyphenyl)propionic acid 3-methylbut-2-enyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 430.214409442 u
Formula C28H30O4
InChI InChI=1S/C28H30O4/c1-22(2)17-18-30-28(29)16-14-25-13-15-26(31-20-23-9-5-3-6-10-23)19-27(25)32-21-24-11-7-4-8-12-24/h3-13,15,17,19H,14,16,18,20-21H2,1-2H3
InChIKey FSBWBCQWIQQTJB-UHFFFAOYSA-N
Molecular Weight 430.544 g/mol
SMILES C1(=CC(OCC=2C=CC=CC2)=CC=C1CCC(=O)OCC=C(C)C)OCC1=CC=CC=C1