| SpectraBase Compound ID | EfETeLHARsS |
|---|---|
| InChI | InChI=1S/C14H17BrO4/c1-2-8-18-13(16)6-7-14(17)19-10-11-4-3-5-12(15)9-11/h3-5,9H,2,6-8,10H2,1H3 |
| InChIKey | DHLPDFNKUSGHCZ-UHFFFAOYSA-N |
| Mol Weight | 329.19 g/mol |
| Molecular Formula | C14H17BrO4 |
| Exact Mass | 328.031022 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7XSp2X57sui |
|---|---|
| Name | Succinic acid, 3-bromobenzyl propyl 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/c1-2-8-18-13(16)6-7-14(17)19-10-11-4-3-5-12(15)9-11/h3-5,9H,2,6-8,10H2,1H3 |
| InChIKey | DHLPDFNKUSGHCZ-UHFFFAOYSA-N |
| Molecular Weight | 329.190 g/mol |
| SMILES | C(OC(=O)CCC(OCCC)=O)C1=CC(=CC=C1)Br |