| SpectraBase Compound ID | 92BIjW5nlR8 |
|---|---|
| InChI | InChI=1S/C22H40O4/c1-2-3-4-5-6-7-8-11-14-19-25-21(23)17-18-22(24)26-20-15-12-9-10-13-16-20/h20H,2-19H2,1H3 |
| InChIKey | KTPRMBBFNKBTPR-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 | 8XWdHns94xG |
|---|---|
| Name | Succinic acid, cycloheptyl undecyl 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/c1-2-3-4-5-6-7-8-11-14-19-25-21(23)17-18-22(24)26-20-15-12-9-10-13-16-20/h20H,2-19H2,1H3 |
| InChIKey | KTPRMBBFNKBTPR-UHFFFAOYSA-N |
| Molecular Weight | 368.558 g/mol |
| SMILES | C(CCCCCCOC(CCC(OC1CCCCCC1)=O)=O)CCCC |