| SpectraBase Compound ID | Eqbw8FcZTJb |
|---|---|
| InChI | InChI=1S/C7H12O3/c1-7(3-2-4-8)9-5-6-10-7/h4H,2-3,5-6H2,1H3 |
| InChIKey | OGTSPQXEOKPHMW-UHFFFAOYSA-N |
| Mol Weight | 144.17 g/mol |
| Molecular Formula | C7H12O3 |
| Exact Mass | 144.078644 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | CXmBqvvi11c |
|---|---|
| Name | 1,3-Dioxolane-2-propanal, 2-methyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 144.078644243 u |
| Formula | C7H12O3 |
| InChI | InChI=1S/C7H12O3/c1-7(3-2-4-8)9-5-6-10-7/h4H,2-3,5-6H2,1H3 |
| InChIKey | OGTSPQXEOKPHMW-UHFFFAOYSA-N |
| SMILES | C(CC=O)C1(C)OCCO1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.941661 |