SpectraBase Spectrum ID |
4sAOl11Y6ri |
Name |
Methyl [4-(4'-phenylphenoxy)]benzoate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
304.109944372 u |
Formula |
C20H16O3 |
InChI |
InChI=1S/C20H16O3/c1-22-20(21)17-9-13-19(14-10-17)23-18-11-7-16(8-12-18)15-5-3-2-4-6-15/h2-14H,1H3 |
InChIKey |
VMPFDZIFQWBILQ-UHFFFAOYSA-N |
SMILES |
C(C=1C=CC(=CC1)OC=1C=CC(=CC1)C=1C=CC=CC1)(=O)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.938545 |