| SpectraBase Compound ID | KVmpVRKZH4L |
|---|---|
| InChI | InChI=1S/C36H64O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-38-36(37)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11-14,17-20H,3-10,15-16,21-35H2,1-2H3/b13-11-,14-12-,19-17-,20-18- |
| InChIKey | BWPODKUVJMQURN-MAZCIEHSSA-N |
| Mol Weight | 528.9 g/mol |
| Molecular Formula | C36H64O2 |
| Exact Mass | 528.490631 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6buX8IGXAcc |
|---|---|
| Name | Linoleyl linoleate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 528.490631299 u |
| Formula | C36H64O2 |
| InChI | InChI=1S/C36H64O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-38-36(37)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11-14,17-20H,3-10,15-16,21-35H2,1-2H3/b13-11-,14-12-,19-17-,20-18- |
| InChIKey | BWPODKUVJMQURN-MAZCIEHSSA-N |
| Molecular Weight | 528.906 g/mol |
| SMILES | C(CCCCCCC\C=C/C\C=C/CCCCC)(=O)OCCCCCCCC\C=C/C\C=C/CCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.979012 |