| SpectraBase Compound ID | IYrqHqsBneS |
|---|---|
| InChI | InChI=1S/C24H42O4/c1-3-5-7-9-11-13-17-21-27-23(25)19-15-16-20-24(26)28-22-18-14-12-10-8-6-4-2/h11-14H,3-10,15-22H2,1-2H3/b13-11-,14-12- |
| InChIKey | HNNPXSADHNHQPV-XSYHWHKQSA-N |
| Mol Weight | 394.6 g/mol |
| Molecular Formula | C24H42O4 |
| Exact Mass | 394.30831 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DI6tPNAtCQd |
|---|---|
| Name | Adipic acid, di(cis-non-3-enyl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 394.308309828 u |
| Formula | C24H42O4 |
| InChI | InChI=1S/C24H42O4/c1-3-5-7-9-11-13-17-21-27-23(25)19-15-16-20-24(26)28-22-18-14-12-10-8-6-4-2/h11-14H,3-10,15-22H2,1-2H3/b13-11-,14-12- |
| InChIKey | HNNPXSADHNHQPV-XSYHWHKQSA-N |
| Molecular Weight | 394.596 g/mol |
| SMILES | C(CCCC(OCC\C=C/CCCCC)=O)C(OCC\C=C/CCCCC)=O |