| SpectraBase Compound ID | IqAg9qfhKkc |
|---|---|
| InChI | InChI=1S/C18H36O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-18(19)20-2/h3-17H2,1-2H3 |
| InChIKey | WZMKUTXQIPEPTH-UHFFFAOYSA-N |
| Mol Weight | 300.5 g/mol |
| Molecular Formula | C18H36O3 |
| Exact Mass | 300.266445 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | LS2PiYokAJ4 |
|---|---|
| Name | Carbonic acid, hexadecyl methyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 300.266445016 u |
| Formula | C18H36O3 |
| InChI | InChI=1S/C18H36O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-18(19)20-2/h3-17H2,1-2H3 |
| InChIKey | WZMKUTXQIPEPTH-UHFFFAOYSA-N |
| SMILES | COC(OCCCCCCCCCCCCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.939101 |