| SpectraBase Compound ID | KRk8Un1Tv9o |
|---|---|
| InChI | InChI=1S/C18H13ClN4OS.BrH/c19-14-8-4-5-9-15(14)23-17(10-11-20)21-22-18(23)25-12-16(24)13-6-2-1-3-7-13;/h1-9H,10,12H2;1H |
| InChIKey | QQZCRPXMYFOTEG-UHFFFAOYSA-N |
| Mol Weight | 449.754 g/mol |
| Molecular Formula | C18H14BrClN4OS |
| Exact Mass | 447.976023 g/mol |
Ultraviolet-Visible (UV-Vis) Spectrum
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| SpectraBase Spectrum ID | HsH4MLTuj3m |
|---|---|
| Name | 4-(o-chlorophenyl)-5-(phenacylthio)-4H-1,2,4-triazole-3-acetonitrile, monohydrobromide |
| Conditions | Neutral |
| Copyright | Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H14BrClN4OS |
| InChI | InChI=1S/C18H13ClN4OS.BrH/c19-14-8-4-5-9-15(14)23-17(10-11-20)21-22-18(23)25-12-16(24)13-6-2-1-3-7-13;/h1-9H,10,12H2;1H |
| InChIKey | QQZCRPXMYFOTEG-UHFFFAOYSA-N |
| Sadtler IR Number | 54024 |
| Sadtler UV Number | 28551N |
| Solvent | Methanol |