For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
methyl 4-{[(7-methyl-2-oxo-4-phenyl-2H-chromen-5-yl)oxy]methyl}benzoate
SpectraBase Compound ID H1chcWhAa7V
InChI InChI=1S/C25H20O5/c1-16-12-21(29-15-17-8-10-19(11-9-17)25(27)28-2)24-20(18-6-4-3-5-7-18)14-23(26)30-22(24)13-16/h3-14H,15H2,1-2H3
InChIKey VJEQXMQCRBHFMO-UHFFFAOYSA-N
Mol Weight 400.43 g/mol
Molecular Formula C25H20O5
Exact Mass 400.131074 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID GzB4Lzvoabc
Name Methyl 4-{[(7-methyl-2-oxo-4-phenyl-2H-chromen-5-yl)oxy]methyl}benzoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 400.131073739 u
Formula C25H20O5
InChI InChI=1S/C25H20O5/c1-16-12-21(29-15-17-8-10-19(11-9-17)25(27)28-2)24-20(18-6-4-3-5-7-18)14-23(26)30-22(24)13-16/h3-14H,15H2,1-2H3
InChIKey VJEQXMQCRBHFMO-UHFFFAOYSA-N
Molecular Weight 400.430 g/mol
SMILES C=1(C=2C(=CC(=CC2OCC=2C=CC(C(=O)OC)=CC2)C)OC(C1)=O)C1=CC=CC=C1