| SpectraBase Compound ID | L5GsRwzpju6 |
|---|---|
| InChI | InChI=1S/C22H40O4/c1-2-3-4-5-6-7-8-9-10-13-19-25-21(23)17-11-12-18-22(24)26-20-15-14-16-20/h20H,2-19H2,1H3 |
| InChIKey | MUUUTRFENCTXPV-UHFFFAOYSA-N |
| Mol Weight | 368.6 g/mol |
| Molecular Formula | C22H40O4 |
| Exact Mass | 368.29266 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5E270YAbonc |
|---|---|
| Name | Adipic acid, cyclobutyl dodecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 368.292659764 u |
| Formula | C22H40O4 |
| InChI | InChI=1S/C22H40O4/c1-2-3-4-5-6-7-8-9-10-13-19-25-21(23)17-11-12-18-22(24)26-20-15-14-16-20/h20H,2-19H2,1H3 |
| InChIKey | MUUUTRFENCTXPV-UHFFFAOYSA-N |
| Molecular Weight | 368.558 g/mol |
| SMILES | C(COC(CCCCC(=O)OC1CCC1)=O)CCCCCCCCCC |