| SpectraBase Compound ID | HHf3d7iaF7b |
|---|---|
| InChI | InChI=1S/C15H8BrNO/c1-2-12-5-3-4-6-14(12)18-15-8-7-11(10-17)9-13(15)16/h1,3-9H |
| InChIKey | DTLYWLGITCRYON-UHFFFAOYSA-N |
| Mol Weight | 298.14 g/mol |
| Molecular Formula | C15H8BrNO |
| Exact Mass | 296.978927 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | K3OiV94jQiY |
|---|---|
| Name | 3-Bromo-4-(2-ethynylphenoxy)benzonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H8BrNO |
| InChI | InChI=1S/C15H8BrNO/c1-2-12-5-3-4-6-14(12)18-15-8-7-11(10-17)9-13(15)16/h1,3-9H |
| InChIKey | DTLYWLGITCRYON-UHFFFAOYSA-N |
| Molecular Weight | 298.139 g/mol |
| SMILES | c1c(Br)c(ccc1C#N)Oc1ccccc1C#C |
| SPLASH | splash10-00kg-0690000000-07e8f11fe8faf591c7f2 |
| Source of Spectrum | ACI-52-SM17-8d |
| Wiley ID | 1781118 |