| SpectraBase Compound ID | AxUUKBifMiV |
|---|---|
| InChI | InChI=1S/C27H50O4/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-20-25-31-27(29)23-21-22-26(28)30-24-19-6-4-2/h4H,2-3,5-25H2,1H3 |
| InChIKey | RUQNILNNMQUGBO-UHFFFAOYSA-N |
| Mol Weight | 438.7 g/mol |
| Molecular Formula | C27H50O4 |
| Exact Mass | 438.37091 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 2kTeV4eoSAH |
|---|---|
| Name | Glutaric acid, heptadecyl pent-4-enyl 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/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-20-25-31-27(29)23-21-22-26(28)30-24-19-6-4-2/h4H,2-3,5-25H2,1H3 |
| InChIKey | RUQNILNNMQUGBO-UHFFFAOYSA-N |
| Molecular Weight | 438.693 g/mol |
| SMILES | CCCCCCCCCCCCCCCCCOC(CCCC(OCCCC=C)=O)=O |