| SpectraBase Compound ID | 2zow8aMJDqB |
|---|---|
| InChI | InChI=1S/C9H11NO3/c1-12-9(11)6-13-8-4-2-7(10)3-5-8/h2-5H,6,10H2,1H3 |
| InChIKey | YDWPOGYTJVQQIL-UHFFFAOYSA-N |
| Mol Weight | 181.19 g/mol |
| Molecular Formula | C9H11NO3 |
| Exact Mass | 181.073893 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2tAj7KfdH8y |
|---|---|
| Name | (4-Aminophenoxy)acetic acid, methyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 181.073893215 u |
| Formula | C9H11NO3 |
| InChI | InChI=1S/C9H11NO3/c1-12-9(11)6-13-8-4-2-7(10)3-5-8/h2-5H,6,10H2,1H3 |
| InChIKey | YDWPOGYTJVQQIL-UHFFFAOYSA-N |
| Molecular Weight | 181.191 g/mol |
| SMILES | C1=CC(=CC=C1OCC(OC)=O)N |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.967439 |