| SpectraBase Compound ID | 7cMaGqVMKIO |
|---|---|
| InChI | InChI=1S/C8H8BrNO2/c1-2-12-8(11)6-3-7(9)5-10-4-6/h3-5H,2H2,1H3 |
| InChIKey | PCPIANOJERKFJI-UHFFFAOYSA-N |
| Mol Weight | 230.06 g/mol |
| Molecular Formula | C8H8BrNO2 |
| Exact Mass | 228.973841 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1ivsDqqMi |
|---|---|
| Name | 5-Bromo-3-pyridinecarboxylic acid ethyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H8BrNO2 |
| InChI | InChI=1S/C8H8BrNO2/c1-2-12-8(11)6-3-7(9)5-10-4-6/h3-5H,2H2,1H3 |
| InChIKey | PCPIANOJERKFJI-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 230.061 g/mol |
| SMILES | CCOC(=O)c1cncc(c1)Br |
| SPLASH | splash10-0zgr-3960000000-c88c5006dba844ea337d |
| Source of Spectrum | SRH-2022-12069-0 |
| Wiley ID | 1833597 |