| SpectraBase Compound ID | LVotNN6Z6MM |
|---|---|
| InChI | InChI=1S/C17H32O3/c1-3-5-7-8-9-10-11-12-13-14-16-20-17(18)19-15-6-4-2/h4H,2-3,5-16H2,1H3 |
| InChIKey | XMSNLFYAVWNTDG-UHFFFAOYSA-N |
| Mol Weight | 284.4 g/mol |
| Molecular Formula | C17H32O3 |
| Exact Mass | 284.235145 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | HMvfu4BcGQZ |
|---|---|
| Name | Carbonic acid, but-3-en-1-yl dodecyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 284.235144887 u |
| Formula | C17H32O3 |
| InChI | InChI=1S/C17H32O3/c1-3-5-7-8-9-10-11-12-13-14-16-20-17(18)19-15-6-4-2/h4H,2-3,5-16H2,1H3 |
| InChIKey | XMSNLFYAVWNTDG-UHFFFAOYSA-N |
| SMILES | C(OCCCCCCCCCCCC)(=O)OCCC=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.866253 |