| SpectraBase Compound ID | 4gPE8MCJyl4 |
|---|---|
| InChI | InChI=1S/C24H40O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26-2/h3-11,16-23H2,1-2H3 |
| InChIKey | BZHUUTOAKXXTMA-UHFFFAOYSA-N |
| Mol Weight | 360.6 g/mol |
| Molecular Formula | C24H40O2 |
| Exact Mass | 360.302831 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7KrHQGxkQgD |
|---|---|
| Name | 10,12-Tricosadiynoic acid, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 360.302830526 u |
| Formula | C24H40O2 |
| InChI | InChI=1S/C24H40O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26-2/h3-11,16-23H2,1-2H3 |
| InChIKey | BZHUUTOAKXXTMA-UHFFFAOYSA-N |
| Molecular Weight | 360.582 g/mol |
| SMILES | C(=O)(OC)CCCCCCCCC#CC#CCCCCCCCCCC |