| SpectraBase Compound ID | 6zgPOQbxvA |
|---|---|
| InChI | InChI=1S/C7H5BrN2O/c8-7-3-5(1-2-9)6(4-11)10-7/h3-4,10H,1H2 |
| InChIKey | ROVZXGXMBRHCRR-UHFFFAOYSA-N |
| Mol Weight | 213.03 g/mol |
| Molecular Formula | C7H5BrN2O |
| Exact Mass | 211.958526 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4z7wblN5VhT |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H5N2OBr |
| InChI | InChI=1S/C7H5BrN2O/c8-7-3-5(1-2-9)6(4-11)10-7/h3-4,10H,1H2 |
| InChIKey | ROVZXGXMBRHCRR-UHFFFAOYSA-N |
| Molecular Weight | 211.9584 |
| SMILES | [nH]1c(cc(c1C=O)CC#N)Br |
| SPLASH | splash10-08g0-7940000000-7a66e975f5633242897e |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |