| SpectraBase Compound ID | yvuBQGpS2t |
|---|---|
| InChI | InChI=1S/C14H28O3/c1-3-4-5-6-7-8-9-10-11-12-13-17-14(15)16-2/h3-13H2,1-2H3 |
| InChIKey | HAWBZAVPHSULBJ-UHFFFAOYSA-N |
| Mol Weight | 244.37 g/mol |
| Molecular Formula | C14H28O3 |
| Exact Mass | 244.203845 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 9wxmXYPAcqe |
|---|---|
| Name | Carbonic acid, dodecyl methyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 244.203844759 u |
| Formula | C14H28O3 |
| InChI | InChI=1S/C14H28O3/c1-3-4-5-6-7-8-9-10-11-12-13-17-14(15)16-2/h3-13H2,1-2H3 |
| InChIKey | HAWBZAVPHSULBJ-UHFFFAOYSA-N |
| Molecular Weight | 244.375 g/mol |
| SMILES | COC(OCCCCCCCCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.866825 |