| SpectraBase Compound ID | 7jCMYxqBNKc |
|---|---|
| InChI | InChI=1S/C15H19BrO5/c1-2-19-14(17)4-3-5-15(18)21-11-10-20-13-8-6-12(16)7-9-13/h6-9H,2-5,10-11H2,1H3 |
| InChIKey | FXENXTKQWGHSGY-UHFFFAOYSA-N |
| Mol Weight | 359.22 g/mol |
| Molecular Formula | C15H19BrO5 |
| Exact Mass | 358.041587 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 | 1QxCJ8iACfD |
|---|---|
| Name | Glutaric acid, 2-(4-bromophenoxy)ethyl ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 358.041586707 u |
| Formula | C15H19BrO5 |
| InChI | InChI=1S/C15H19BrO5/c1-2-19-14(17)4-3-5-15(18)21-11-10-20-13-8-6-12(16)7-9-13/h6-9H,2-5,10-11H2,1H3 |
| InChIKey | FXENXTKQWGHSGY-UHFFFAOYSA-N |
| Molecular Weight | 359.216 g/mol |
| SMILES | C(OCCOC1=CC=C(C=C1)Br)(=O)CCCC(OCC)=O |