| SpectraBase Compound ID | 6EjJE0Sa7ZY |
|---|---|
| InChI | InChI=1S/C10H7BrOS/c11-10-7(5-12)6-13-9-4-2-1-3-8(9)10/h1-5H,6H2 |
| InChIKey | XPKKAQCHSIZJPC-UHFFFAOYSA-N |
| Mol Weight | 255.13 g/mol |
| Molecular Formula | C10H7BrOS |
| Exact Mass | 253.940099 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | lJV5J7HSFp |
|---|---|
| Name | 4-Bromo-2H-1-benzothiopyran-3-carbaldehyde |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H7BrOS |
| InChI | InChI=1S/C10H7BrOS/c11-10-7(5-12)6-13-9-4-2-1-3-8(9)10/h1-5H,6H2 |
| InChIKey | XPKKAQCHSIZJPC-UHFFFAOYSA-N |
| Molecular Weight | 255.129 g/mol |
| SMILES | C1C(=C(c2c(S1)cccc2)Br)C=O |
| SPLASH | splash10-004j-2960000000-2a36b08e63b98595d0d4 |
| Source of Spectrum | QE-5-1042-1 |
| Wiley ID | 844113 |