| SpectraBase Compound ID | 258J0Wn8ANu |
|---|---|
| InChI | InChI=1S/C12H6BrN3/c13-7-1-3-8-9(4-2-7)11(6-15)12(16)10(8)5-14/h1-4H,16H2 |
| InChIKey | LTPMFSWHJMHISK-UHFFFAOYSA-N |
| Mol Weight | 272.1 g/mol |
| Molecular Formula | C12H6BrN3 |
| Exact Mass | 270.97451 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GcGiUCLL4H4 |
|---|---|
| Name | 1,3-AZULENEDICARBONITRILE, 2-AMINO-6-BROMO- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H6N3Br |
| InChI | InChI=1S/C12H6BrN3/c13-7-1-3-8-9(4-2-7)11(6-15)12(16)10(8)5-14/h1-4H,16H2 |
| InChIKey | LTPMFSWHJMHISK-UHFFFAOYSA-N |
| Molecular Weight | 270.9744 |
| SMILES | Nc1c(C#N)c2ccc(Br)ccc2c1C#N |
| SPLASH | splash10-00di-7790000000-e200c78aea5ae863c727 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |