| SpectraBase Compound ID | oKGHRjNB41 |
|---|---|
| InChI | InChI=1S/C11H16O2/c1-4-6-7-9-13-11(12)10(3)8-5-2/h4-8,10H,1,9H2,2-3H3/b7-6+,8-5+ |
| InChIKey | XRMDZWWOUWRSMZ-ZCOYIIAOSA-N |
| Mol Weight | 180.25 g/mol |
| Molecular Formula | C11H16O2 |
| Exact Mass | 180.11503 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | A3LhNyK1UUI |
|---|---|
| Name | 2,4-Pentadienyl 2-methyl-3-pentenoate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 180.115029753 u |
| Formula | C11H16O2 |
| InChI | InChI=1S/C11H16O2/c1-4-6-7-9-13-11(12)10(3)8-5-2/h4-8,10H,1,9H2,2-3H3/b7-6+,8-5+ |
| InChIKey | XRMDZWWOUWRSMZ-ZCOYIIAOSA-N |
| Molecular Weight | 180.247 g/mol |
| SMILES | C(=O)(C(\C=C\C)C)OC\C=C\C=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.876755 |