| SpectraBase Compound ID | KFy6TnJ0dM5 |
|---|---|
| InChI | InChI=1S/C8H9NO3/c9-6-1-3-7(4-2-6)12-5-8(10)11/h1-4H,5,9H2,(H,10,11) |
| InChIKey | GIFGMEWQGDEWKB-UHFFFAOYSA-N |
| Mol Weight | 167.16 g/mol |
| Molecular Formula | C8H9NO3 |
| Exact Mass | 167.058243 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | J3uX3cenYI |
|---|---|
| Name | (p-Aminophenoxy)acetic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 167.058243151 u |
| Formula | C8H9NO3 |
| InChI | InChI=1S/C8H9NO3/c9-6-1-3-7(4-2-6)12-5-8(10)11/h1-4H,5,9H2,(H,10,11) |
| InChIKey | GIFGMEWQGDEWKB-UHFFFAOYSA-N |
| Molecular Weight | 167.164 g/mol |
| SMILES | NC1=CC=C(OCC(O)=O)C=C1 |
| Spectrum/Structure Validation Score (Raman) | 0.845305 |