| SpectraBase Compound ID | GPnWwYJFO7M |
|---|---|
| InChI | InChI=1S/C18H34O3/c1-3-5-7-8-9-10-11-12-13-14-15-17-21-18(19)20-16-6-4-2/h4H,2-3,5-17H2,1H3 |
| InChIKey | FFMYCKRHAJEDDC-UHFFFAOYSA-N |
| Mol Weight | 298.5 g/mol |
| Molecular Formula | C18H34O3 |
| Exact Mass | 298.250795 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | DBADToKhtx0 |
|---|---|
| Name | Carbonic acid, but-3-en-1-yl tridecyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.250794952 u |
| Formula | C18H34O3 |
| InChI | InChI=1S/C18H34O3/c1-3-5-7-8-9-10-11-12-13-14-15-17-21-18(19)20-16-6-4-2/h4H,2-3,5-17H2,1H3 |
| InChIKey | FFMYCKRHAJEDDC-UHFFFAOYSA-N |
| SMILES | C(OCCCCCCCCCCCCC)(=O)OCCC=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.839177 |