| SpectraBase Spectrum ID |
7bKlA8I4TbZ |
| Name |
Methyl 4-{[(3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy]methyl}benzoate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
414.146723803 u |
| Formula |
C26H22O5 |
| InChI |
InChI=1S/C26H22O5/c1-17-22-13-12-21(30-16-19-8-10-20(11-9-19)25(27)29-2)15-24(22)31-26(28)23(17)14-18-6-4-3-5-7-18/h3-13,15H,14,16H2,1-2H3 |
| InChIKey |
PVTKRCZPHPKQAS-UHFFFAOYSA-N |
| Molecular Weight |
414.457 g/mol |
| SMILES |
C=1(C(OC=2C(C1C)=CC=C(OCC=1C=CC(C(=O)OC)=CC1)C2)=O)CC=1C=CC=CC1 |
![methyl 4-{[(3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy]methyl}benzoate](/api/spectrum/7bKlA8I4TbZ/structure.png?h=300&w=458 "methyl 4-{[(3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy]methyl}benzoate")
