| SpectraBase Compound ID | 70nkj04fm7p |
|---|---|
| InChI | InChI=1S/C12H20O3/c1-15-12(14)10-8-6-4-2-3-5-7-9-11-13/h7,9,11H,2-6,8,10H2,1H3/b9-7+ |
| InChIKey | MGEJSRKZEJDCJG-VQHVLOKHSA-N |
| Mol Weight | 212.29 g/mol |
| Molecular Formula | C12H20O3 |
| Exact Mass | 212.141245 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 7FwXWoxBgTJ |
|---|---|
| Name | Methyl 11-oxo-9-undecenoate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.141244501 u |
| Formula | C12H20O3 |
| InChI | InChI=1S/C12H20O3/c1-15-12(14)10-8-6-4-2-3-5-7-9-11-13/h7,9,11H,2-6,8,10H2,1H3/b9-7+ |
| InChIKey | MGEJSRKZEJDCJG-VQHVLOKHSA-N |
| Molecular Weight | 212.289 g/mol |
| SMILES | C(=O)\C=C\CCCCCCCC(OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.907003 |