| SpectraBase Compound ID | C3Mg7R1QvGk |
|---|---|
| InChI | InChI=1S/C8H13BrO2/c1-3-4-5-7(6-9)8(10)11-2/h5H,3-4,6H2,1-2H3/b7-5- |
| InChIKey | IYVQTCXBSWIDQZ-ALCCZGGFSA-N |
| Mol Weight | 221.09 g/mol |
| Molecular Formula | C8H13BrO2 |
| Exact Mass | 220.009893 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Hn7wKX6zigy |
|---|---|
| Name | 2-(bromomethyl)-2-hexenoic acid, methyl ester |
| CAS Registry Number | 87050-38-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H13BrO2 |
| InChI | InChI=1S/C8H13BrO2/c1-3-4-5-7(6-9)8(10)11-2/h5H,3-4,6H2,1-2H3/b7-5- |
| InChIKey | IYVQTCXBSWIDQZ-ALCCZGGFSA-N |
| Molecular Weight | 221.094 g/mol |
| SMILES | C(\C(=C/CCC)CBr)(=O)OC |
| SPLASH | splash10-0a5c-6900000000-9a7c5cefbe6caa3772dc |
| Source of Spectrum | J-50-3857-17 |
| Wiley ID | 1219281 |