SpectraBase Spectrum ID |
5CMSYxdqDn1 |
Name |
p-(2-Phenoxyethoxy)benzoic acid |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
258.089208927 u |
Formula |
C15H14O4 |
InChI |
InChI=1S/C15H14O4/c16-15(17)12-6-8-14(9-7-12)19-11-10-18-13-4-2-1-3-5-13/h1-9H,10-11H2,(H,16,17) |
InChIKey |
MIFKBDZVXBJUFX-UHFFFAOYSA-N |
Molecular Weight |
258.273 g/mol |
SMILES |
OC(C=1C=CC(=CC1)OCCOC=1C=CC=CC1)=O |
Spectrum/Structure Validation Score (Raman) |
0.997847 |