| SpectraBase Compound ID | 15yUnJuXGD8 |
|---|---|
| InChI | InChI=1S/C5H6O2/c1-3-2-4(3)5(6)7/h4H,1-2H2,(H,6,7) |
| InChIKey | QJUQASYVMKRUMN-UHFFFAOYSA-N |
| Mol Weight | 98.1 g/mol |
| Molecular Formula | C5H6O2 |
| Exact Mass | 98.036779 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4dYD7LkiQFb |
|---|---|
| Name | Methylenecyclopropanecarboxylic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 98.036779431 u |
| Formula | C5H6O2 |
| InChI | InChI=1S/C5H6O2/c1-3-2-4(3)5(6)7/h4H,1-2H2,(H,6,7) |
| InChIKey | QJUQASYVMKRUMN-UHFFFAOYSA-N |
| Molecular Weight | 98.101 g/mol |
| SMILES | C1(CC1C(O)=O)=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.969825 |