| SpectraBase Compound ID | 11za40OwDEa |
|---|---|
| InChI | InChI=1S/C6H10O3/c7-6(8)5-3-1-2-4-9-5/h5H,1-4H2,(H,7,8) |
| InChIKey | MQAYFGXOFCEZRW-UHFFFAOYSA-N |
| Mol Weight | 130.14 g/mol |
| Molecular Formula | C6H10O3 |
| Exact Mass | 130.062994 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Br4gVWDNKoC |
|---|---|
| Name | Oxane-2-carboxylic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 130.062994179 u |
| Formula | C6H10O3 |
| InChI | InChI=1S/C6H10O3/c7-6(8)5-3-1-2-4-9-5/h5H,1-4H2,(H,7,8) |
| InChIKey | MQAYFGXOFCEZRW-UHFFFAOYSA-N |
| SMILES | C(O)(=O)C1OCCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.841948 |