| SpectraBase Compound ID | EnawkT4kIPi |
|---|---|
| InChI | InChI=1S/C10H7BrOS/c11-6-7-5-10(12)13-9-4-2-1-3-8(7)9/h1-5H,6H2 |
| InChIKey | BEHWUMJVFQCURS-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 | Ll6PsYA8Gil |
|---|---|
| Name | 4-(bromomethyl)-1-benzothiopyran-2-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H7BrOS |
| InChI | InChI=1S/C10H7BrOS/c11-6-7-5-10(12)13-9-4-2-1-3-8(7)9/h1-5H,6H2 |
| InChIKey | BEHWUMJVFQCURS-UHFFFAOYSA-N |
| Molecular Weight | 255.129 g/mol |
| SMILES | C1(Sc2c(C(=C1)CBr)cccc2)=O |
| SPLASH | splash10-0kdi-0290000000-b503dddf6bf89efea67a |
| Source of Spectrum | Y-29-138-4 |
| Synonyms | 4-(bromomethyl)thiochromen-2-one |
| Wiley ID | 1257182 |