| SpectraBase Compound ID | I3s2KRxyGsu |
|---|---|
| InChI | InChI=1S/C8H6BrNO3/c9-5-8(11)6-1-3-7(4-2-6)10(12)13/h1-4H,5H2 |
| InChIKey | MBUPVGIGAMCMBT-UHFFFAOYSA-N |
| Mol Weight | 244.04 g/mol |
| Molecular Formula | C8H6BrNO3 |
| Exact Mass | 242.953106 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FuQjAP2IP76 |
|---|---|
| Name | omega-BROMO-4-NITROACETOPHENONE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H6BrNO3 |
| InChI | InChI=1S/C8H6BrNO3/c9-5-8(11)6-1-3-7(4-2-6)10(12)13/h1-4H,5H2 |
| InChIKey | MBUPVGIGAMCMBT-UHFFFAOYSA-N |
| Molecular Weight | 242.9529 |
| SMILES | c1(N(=O)=O)ccc(C(CBr)=O)cc1 |
| SPLASH | splash10-0udi-7900000000-3668645655239805962c |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |