| SpectraBase Compound ID | JiLTf7D7CiP |
|---|---|
| InChI | InChI=1S/C12H16O4/c1-4-16-10-7-5-9(6-8-10)12(2,14)11(13)15-3/h5-8,14H,4H2,1-3H3 |
| InChIKey | NPXZGHNPPJMHEI-UHFFFAOYSA-N |
| Mol Weight | 224.26 g/mol |
| Molecular Formula | C12H16O4 |
| Exact Mass | 224.104859 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | FLJZnTNZ4Uu |
|---|---|
| Name | Methyl 2-(4-ethoxyphenyl)lactate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 224.104858991 u |
| Formula | C12H16O4 |
| InChI | InChI=1S/C12H16O4/c1-4-16-10-7-5-9(6-8-10)12(2,14)11(13)15-3/h5-8,14H,4H2,1-3H3 |
| InChIKey | NPXZGHNPPJMHEI-UHFFFAOYSA-N |
| Molecular Weight | 224.256 g/mol |
| SMILES | C(O)(C1=CC=C(C=C1)OCC)(C)C(OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.919085 |