| SpectraBase Compound ID | Bmq3u7XvFM5 |
|---|---|
| InChI | InChI=1S/C24H32O4/c1-2-3-4-5-11-19-27-23(25)17-7-6-8-18-24(26)28-22-16-12-14-20-13-9-10-15-21(20)22/h9-10,12-16H,2-8,11,17-19H2,1H3 |
| InChIKey | IBQZDAVXKMXFGS-UHFFFAOYSA-N |
| Mol Weight | 384.5 g/mol |
| Molecular Formula | C24H32O4 |
| Exact Mass | 384.23006 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 | Ik07GqBkme1 |
|---|---|
| Name | Pimelic acid, heptyl 1-naphthyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 384.230059506 u |
| Formula | C24H32O4 |
| InChI | InChI=1S/C24H32O4/c1-2-3-4-5-11-19-27-23(25)17-7-6-8-18-24(26)28-22-16-12-14-20-13-9-10-15-21(20)22/h9-10,12-16H,2-8,11,17-19H2,1H3 |
| InChIKey | IBQZDAVXKMXFGS-UHFFFAOYSA-N |
| Molecular Weight | 384.516 g/mol |
| SMILES | C(OC1=CC=CC2=C1C=CC=C2)(=O)CCCCCC(OCCCCCCC)=O |