| SpectraBase Compound ID | 5lQVR7Uof3O |
|---|---|
| InChI | InChI=1S/C27H50O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-23-30-26(28)21-22-27(29)31-24-25-19-16-15-17-20-25/h25H,2-24H2,1H3 |
| InChIKey | AKFKQRDHLFAUKA-UHFFFAOYSA-N |
| Mol Weight | 438.7 g/mol |
| Molecular Formula | C27H50O4 |
| Exact Mass | 438.37091 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G3QfCHMUs3w |
|---|---|
| Name | Succinic acid, cyclohexylmethyl hexadecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 438.370910086 u |
| Formula | C27H50O4 |
| InChI | InChI=1S/C27H50O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-23-30-26(28)21-22-27(29)31-24-25-19-16-15-17-20-25/h25H,2-24H2,1H3 |
| InChIKey | AKFKQRDHLFAUKA-UHFFFAOYSA-N |
| Molecular Weight | 438.693 g/mol |
| SMILES | C(CCCCCCOC(CCC(OCC1CCCCC1)=O)=O)CCCCCCCCC |