| SpectraBase Compound ID | GBn0mLZTsqL |
|---|---|
| InChI | InChI=1S/C24H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-23(27)21(25)19-22(26)24(20)28/h19,25,28H,2-18H2,1H3 |
| InChIKey | GDWBUZPQZFDIEB-UHFFFAOYSA-N |
| Mol Weight | 392.6 g/mol |
| Molecular Formula | C24H40O4 |
| Exact Mass | 392.29266 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6nD72E0E4sS |
|---|---|
| Name | 2,5-Cyclohexadiene-1,4-dione, 2,5-dihydroxy-3-octadecyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 392.292659764 u |
| Formula | C24H40O4 |
| InChI | InChI=1S/C24H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-23(27)21(25)19-22(26)24(20)28/h19,25,28H,2-18H2,1H3 |
| InChIKey | GDWBUZPQZFDIEB-UHFFFAOYSA-N |
| Molecular Weight | 392.580 g/mol |
| SMILES | C(CC=1C(=O)C(O)=CC(C1O)=O)CCCCCCCCCCCCCCCC |