| SpectraBase Compound ID | BcOOon4GuDA |
|---|---|
| InChI | InChI=1S/C11H18O4/c1-8(2)6-7-11(3,9(12)14-4)10(13)15-5/h6H,7H2,1-5H3 |
| InChIKey | VUKZXEDSPQUSMP-UHFFFAOYSA-N |
| Mol Weight | 214.26 g/mol |
| Molecular Formula | C11H18O4 |
| Exact Mass | 214.120509 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | It9q98ej3O4 |
|---|---|
| Name | 2-Methyl-2-(3-methylbut-2-en-1-yl)malonate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 214.120509056 u |
| Formula | C11H18O4 |
| InChI | InChI=1S/C11H18O4/c1-8(2)6-7-11(3,9(12)14-4)10(13)15-5/h6H,7H2,1-5H3 |
| InChIKey | VUKZXEDSPQUSMP-UHFFFAOYSA-N |
| Molecular Weight | 214.261 g/mol |
| SMILES | C(C(=O)OC)(C(=O)OC)(CC=C(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.927596 |