| SpectraBase Compound ID | 5xWVU66Uki9 |
|---|---|
| InChI | InChI=1S/C13H10O4/c14-10-3-7-12(8-4-10)17-11-5-1-9(2-6-11)13(15)16/h1-8,14H,(H,15,16) |
| InChIKey | KLXPCYHWTLAVLN-UHFFFAOYSA-N |
| Mol Weight | 230.22 g/mol |
| Molecular Formula | C13H10O4 |
| Exact Mass | 230.057909 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | HOzR2Ajx41y |
|---|---|
| Name | p-(p-Hydroxyphenoxy)benzoic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 230.057908798 u |
| Formula | C13H10O4 |
| InChI | InChI=1S/C13H10O4/c14-10-3-7-12(8-4-10)17-11-5-1-9(2-6-11)13(15)16/h1-8,14H,(H,15,16) |
| InChIKey | KLXPCYHWTLAVLN-UHFFFAOYSA-N |
| Molecular Weight | 230.219 g/mol |
| SMILES | OC1=CC=C(OC=2C=CC(C(O)=O)=CC2)C=C1 |
| Spectrum/Structure Validation Score (Raman) | 0.992618 |