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5-[3-Methoxy-(bis-4-methoxyphenyl)methyl]phenoxylevulinic acid methyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

5-[3-Methoxy-(bis-4-methoxyphenyl)methyl]phenoxylevulinic acid methyl ester
SpectraBase Compound ID 8YN4W5Be5l3
InChI InChI=1S/C28H30O7/c1-31-24-13-8-20(9-14-24)28(34-4,21-10-15-25(32-2)16-11-21)22-6-5-7-26(18-22)35-19-23(29)12-17-27(30)33-3/h5-11,13-16,18H,12,17,19H2,1-4H3
InChIKey LINPWUBUOXMDSL-UHFFFAOYSA-N
Mol Weight 478.54 g/mol
Molecular Formula C28H30O7
Exact Mass 478.199153 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3YCAesVdLF9
Name 5-[3-Methoxy-(bis-4-methoxyphenyl)methyl]phenoxylevulinic acid methyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 478.199153299 u
Formula C28H30O7
InChI InChI=1S/C28H30O7/c1-31-24-13-8-20(9-14-24)28(34-4,21-10-15-25(32-2)16-11-21)22-6-5-7-26(18-22)35-19-23(29)12-17-27(30)33-3/h5-11,13-16,18H,12,17,19H2,1-4H3
InChIKey LINPWUBUOXMDSL-UHFFFAOYSA-N
Molecular Weight 478.541 g/mol
SMILES C(C=1C=C(OCC(=O)CCC(=O)OC)C=CC1)(C=1C=CC(=CC1)OC)(C1=CC=C(C=C1)OC)OC