| SpectraBase Compound ID | 3Xd516nxcGe |
|---|---|
| InChI | InChI=1S/C11H20O2/c1-6-7-8-11(3,4)9(2)10(12)13-5/h2,6-8H2,1,3-5H3 |
| InChIKey | OJJIOUCGPVKQNQ-UHFFFAOYSA-N |
| Mol Weight | 184.28 g/mol |
| Molecular Formula | C11H20O2 |
| Exact Mass | 184.14633 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Kp0Sp7o84te |
|---|---|
| Name | Methyl 2-(1',1'-dimethylpentyl)prop-2-enoate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 184.146329882 u |
| Formula | C11H20O2 |
| InChI | InChI=1S/C11H20O2/c1-6-7-8-11(3,4)9(2)10(12)13-5/h2,6-8H2,1,3-5H3 |
| InChIKey | OJJIOUCGPVKQNQ-UHFFFAOYSA-N |
| Molecular Weight | 184.279 g/mol |
| SMILES | C(C(=O)OC)(C(CCCC)(C)C)=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.990341 |