| SpectraBase Compound ID | 3Arws6sLMDw |
|---|---|
| InChI | InChI=1S/C7H12O2/c1-5(2)9-7(8)6-3-4-6/h5-6H,3-4H2,1-2H3 |
| InChIKey | QEYGAMYURHNUMI-UHFFFAOYSA-N |
| Mol Weight | 128.17 g/mol |
| Molecular Formula | C7H12O2 |
| Exact Mass | 128.08373 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8SpNRXTTOSN |
|---|---|
| Name | Cyclopropanecarboxylic acid,isopropyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 128.083729624 u |
| Formula | C7H12O2 |
| InChI | InChI=1S/C7H12O2/c1-5(2)9-7(8)6-3-4-6/h5-6H,3-4H2,1-2H3 |
| InChIKey | QEYGAMYURHNUMI-UHFFFAOYSA-N |
| SMILES | CC(OC(C1CC1)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.904564 |