| SpectraBase Compound ID | 9F4rTxV84vL |
|---|---|
| InChI | InChI=1S/C14H25BrO4/c1-2-11-18-13(16)8-9-14(17)19-12-7-5-3-4-6-10-15/h2-12H2,1H3 |
| InChIKey | DTZQWUGZKDVXIX-UHFFFAOYSA-N |
| Mol Weight | 337.25 g/mol |
| Molecular Formula | C14H25BrO4 |
| Exact Mass | 336.093622 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IhNQwAVKNLg |
|---|---|
| Name | Succinic acid, 7-bromoheptyl propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 336.093622281 u |
| Formula | C14H25BrO4 |
| InChI | InChI=1S/C14H25BrO4/c1-2-11-18-13(16)8-9-14(17)19-12-7-5-3-4-6-10-15/h2-12H2,1H3 |
| InChIKey | DTZQWUGZKDVXIX-UHFFFAOYSA-N |
| Molecular Weight | 337.254 g/mol |
| SMILES | C(OC(=O)CCC(OCCC)=O)CCCCCCBr |