| SpectraBase Compound ID | 7Fb9zvCx5r5 |
|---|---|
| InChI | InChI=1S/C13H15BrO4/c1-2-9-17-12(15)7-8-13(16)18-11-5-3-10(14)4-6-11/h3-6H,2,7-9H2,1H3 |
| InChIKey | VISHEJFIXSYMNM-UHFFFAOYSA-N |
| Mol Weight | 315.16 g/mol |
| Molecular Formula | C13H15BrO4 |
| Exact Mass | 314.015372 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HI6y7uBn27f |
|---|---|
| Name | Succinic acid, 4-bromophenyl propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 314.015371959 u |
| Formula | C13H15BrO4 |
| InChI | InChI=1S/C13H15BrO4/c1-2-9-17-12(15)7-8-13(16)18-11-5-3-10(14)4-6-11/h3-6H,2,7-9H2,1H3 |
| InChIKey | VISHEJFIXSYMNM-UHFFFAOYSA-N |
| Molecular Weight | 315.163 g/mol |
| SMILES | C(CCC(OC1=CC=C(C=C1)Br)=O)(OCCC)=O |