| SpectraBase Compound ID | 33xg3bm01rc |
|---|---|
| InChI | InChI=1S/C12H23BrO2/c1-4-15-12(14)11(9-10(2)3)7-5-6-8-13/h10-11H,4-9H2,1-3H3 |
| InChIKey | SDMQDJVGVZDALB-UHFFFAOYSA-N |
| Mol Weight | 279.22 g/mol |
| Molecular Formula | C12H23BrO2 |
| Exact Mass | 278.088143 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 | 8YAlfH0kYiT |
|---|---|
| Name | Ethyl 6-bromo-2-isobutylhexanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 278.088142979 u |
| Formula | C12H23BrO2 |
| InChI | InChI=1S/C12H23BrO2/c1-4-15-12(14)11(9-10(2)3)7-5-6-8-13/h10-11H,4-9H2,1-3H3 |
| InChIKey | SDMQDJVGVZDALB-UHFFFAOYSA-N |
| Molecular Weight | 279.218 g/mol |
| SMILES | C(C(CC(C)C)CCCCBr)(=O)OCC |