| SpectraBase Compound ID | BhVdWHuiusP |
|---|---|
| InChI | InChI=1S/C15H27BrO4/c1-2-3-12-19-14(17)9-10-15(18)20-13-8-6-4-5-7-11-16/h2-13H2,1H3 |
| InChIKey | MQYCDKRGPGXBKE-UHFFFAOYSA-N |
| Mol Weight | 351.28 g/mol |
| Molecular Formula | C15H27BrO4 |
| Exact Mass | 350.109272 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CZ59A6JIxld |
|---|---|
| Name | Succinic acid, 7-bromoheptyl butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 350.109272345 u |
| Formula | C15H27BrO4 |
| InChI | InChI=1S/C15H27BrO4/c1-2-3-12-19-14(17)9-10-15(18)20-13-8-6-4-5-7-11-16/h2-13H2,1H3 |
| InChIKey | MQYCDKRGPGXBKE-UHFFFAOYSA-N |
| Molecular Weight | 351.281 g/mol |
| SMILES | C(OC(=O)CCC(OCCCC)=O)CCCCCCBr |