![Acetic acid, 2-[(2-methoxybenzyl)oxy]-](/api/spectrum/3Q8SXOMXuC7/structure.png?h=300&w=458 "Acetic acid, 2-[(2-methoxybenzyl)oxy]-")
| SpectraBase Compound ID | F1FXcPjcCyQ |
|---|---|
| InChI | InChI=1S/C10H12O4/c1-13-9-5-3-2-4-8(9)6-14-7-10(11)12/h2-5H,6-7H2,1H3,(H,11,12) |
| InChIKey | FRGJPVWNZSVXRA-UHFFFAOYSA-N |
| Mol Weight | 196.2 g/mol |
| Molecular Formula | C10H12O4 |
| Exact Mass | 196.073559 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3Q8SXOMXuC7 |
|---|---|
| Name | Acetic acid, 2-[(2-methoxybenzyl)oxy]- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.073558862 u |
| Formula | C10H12O4 |
| InChI | InChI=1S/C10H12O4/c1-13-9-5-3-2-4-8(9)6-14-7-10(11)12/h2-5H,6-7H2,1H3,(H,11,12) |
| InChIKey | FRGJPVWNZSVXRA-UHFFFAOYSA-N |
| Molecular Weight | 196.202 g/mol |
| SMILES | C1(=C(C=CC=C1)COCC(O)=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.972265 |