| SpectraBase Compound ID | L0VYnhnTpAU |
|---|---|
| InChI | InChI=1S/C22H33BrO4/c1-2-3-4-5-6-7-8-9-17-26-21(24)14-15-22(25)27-18-16-19-10-12-20(23)13-11-19/h10-13H,2-9,14-18H2,1H3 |
| InChIKey | DXDYRPBMAIGBHH-UHFFFAOYSA-N |
| Mol Weight | 441.4 g/mol |
| Molecular Formula | C22H33BrO4 |
| Exact Mass | 440.156223 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 | KFlKmsDX0TU |
|---|---|
| Name | Succinic acid, 4-bromophenethyl decyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 440.156222539 u |
| Formula | C22H33BrO4 |
| InChI | InChI=1S/C22H33BrO4/c1-2-3-4-5-6-7-8-9-17-26-21(24)14-15-22(25)27-18-16-19-10-12-20(23)13-11-19/h10-13H,2-9,14-18H2,1H3 |
| InChIKey | DXDYRPBMAIGBHH-UHFFFAOYSA-N |
| Molecular Weight | 441.406 g/mol |
| SMILES | C(CCC(OCCC1=CC=C(C=C1)Br)=O)(OCCCCCCCCCC)=O |