| SpectraBase Compound ID | Bqu3MOm1ZaW |
|---|---|
| InChI | InChI=1S/C9H5BrN2O3/c10-7-5-11(13)4-6-2-1-3-8(9(6)7)12(14)15/h1-5H |
| InChIKey | IATFRFNHJCVWBR-UHFFFAOYSA-N |
| Mol Weight | 269.05 g/mol |
| Molecular Formula | C9H5BrN2O3 |
| Exact Mass | 267.948355 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1NP9CQTRi5Q |
|---|---|
| Name | 4-BROMO,5-NITRO-ISOQUINOLINE-N-OXIDE |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C9H5BrN2O3/c10-7-5-11(13)4-6-2-1-3-8(9(6)7)12(14)15/h1-5H |
| InChIKey | IATFRFNHJCVWBR-UHFFFAOYSA-N |
| Literature Reference | W.WERRA,D.HEBER,U.HOLZGRABE MAGN.RES.CHEM.,30,640(1992) |
| Solvent | Dimethyl sulfoxide-d6 |