| SpectraBase Compound ID | 7Lprg1uzmJz |
|---|---|
| InChI | InChI=1S/C14H17BrO4/c1-2-18-13(16)7-8-14(17)19-10-9-11-5-3-4-6-12(11)15/h3-6H,2,7-10H2,1H3 |
| InChIKey | YMWIJYGGRDRGDN-UHFFFAOYSA-N |
| Mol Weight | 329.19 g/mol |
| Molecular Formula | C14H17BrO4 |
| Exact Mass | 328.031022 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 | IRXOUPVqqhj |
|---|---|
| Name | Succinic acid, 2-bromophenethyl ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 328.031022023 u |
| Formula | C14H17BrO4 |
| InChI | InChI=1S/C14H17BrO4/c1-2-18-13(16)7-8-14(17)19-10-9-11-5-3-4-6-12(11)15/h3-6H,2,7-10H2,1H3 |
| InChIKey | YMWIJYGGRDRGDN-UHFFFAOYSA-N |
| Molecular Weight | 329.190 g/mol |
| SMILES | C(CCC(OCCC1=C(C=CC=C1)Br)=O)(OCC)=O |