| SpectraBase Compound ID | JJwL3tDsw8l |
|---|---|
| InChI | InChI=1S/C13H24O2/c1-3-5-6-7-8-9-10-11-12-13(14)15-4-2/h11-12H,3-10H2,1-2H3/b12-11- |
| InChIKey | PERJJPDPIXBRBO-QXMHVHEDSA-N |
| Mol Weight | 212.33 g/mol |
| Molecular Formula | C13H24O2 |
| Exact Mass | 212.17763 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | H4AvIMbfFuC |
|---|---|
| Name | (Z)-2-Undecenoic acid ethyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.177630011 u |
| Formula | C13H24O2 |
| InChI | InChI=1S/C13H24O2/c1-3-5-6-7-8-9-10-11-12-13(14)15-4-2/h11-12H,3-10H2,1-2H3/b12-11- |
| InChIKey | PERJJPDPIXBRBO-QXMHVHEDSA-N |
| Molecular Weight | 212.333 g/mol |
| SMILES | C(\C=C/CCCCCCCC)(=O)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.930722 |