| SpectraBase Compound ID | Lm2nOWDreR3 |
|---|---|
| InChI | InChI=1S/C7H10O4/c1-6(2)3-7(6,4(8)9)5(10)11/h3H2,1-2H3,(H,8,9)(H,10,11) |
| InChIKey | WGVXKBCLWVEKFR-UHFFFAOYSA-N |
| Mol Weight | 158.15 g/mol |
| Molecular Formula | C7H10O4 |
| Exact Mass | 158.057909 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 1ozFdG07zKD |
|---|---|
| Name | 2,2-Dimethylcyclopropane-1,1-dicarboxylic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 158.057908798 u |
| Formula | C7H10O4 |
| InChI | InChI=1S/C7H10O4/c1-6(2)3-7(6,4(8)9)5(10)11/h3H2,1-2H3,(H,8,9)(H,10,11) |
| InChIKey | WGVXKBCLWVEKFR-UHFFFAOYSA-N |
| SMILES | C(O)(C1(C(C1)(C)C)C(=O)O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.898164 |