| SpectraBase Compound ID | 1TfUJPD9Pz5 |
|---|---|
| InChI | InChI=1S/C8H5BrN2OS/c9-6-3-1-5(2-4-6)7-8(12)11-13-10-7/h1-4H,(H,11,12) |
| InChIKey | BKMKIOIDICTRLH-UHFFFAOYSA-N |
| Mol Weight | 257.1 g/mol |
| Molecular Formula | C8H5BrN2OS |
| Exact Mass | 255.930597 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2zdIDLVq64 |
|---|---|
| Name | 4-(4-bromophenyl)-1,2,5-thiadiazol-3-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H5BrN2OS |
| InChI | InChI=1S/C8H5BrN2OS/c9-6-3-1-5(2-4-6)7-8(12)11-13-10-7/h1-4H,(H,11,12) |
| InChIKey | BKMKIOIDICTRLH-UHFFFAOYSA-N |
| Molecular Weight | 257.105 g/mol |
| SMILES | Oc1c(nsn1)-c1ccc(cc1)Br |
| SPLASH | splash10-0a4i-1190000000-5917a4f0100c82711988 |
| Source of Spectrum | Y-36-522-12 |
| Wiley ID | 762147 |