N2-(4-Bromo-5-methylisoxazol-3-yl)-5-nitro-2-furamide

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Systematic / IUPAC Name: N-(4-Bromo-5-methyl-1,2-oxazol-3-yl)-5-nitrofuran-2-carboxamide

ID: Reference8730

Other Names: 2-Furancarboxamide, N-(4-bromo-5-methyl-3-isoxazolyl)-5-nitro-;
N-(4-Bromo-5-methyl-isoxazol-3-yl)-5-nitro-2-furamide

Formula: C9H6BrN3O5

Spectral Data

N2-(4-Bromo-5-methylisoxazol-3-yl)-5-nitro-2-furamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 220
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/8/2019 12:32:46 PM
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Identificators

InChI InChI=1S/C9H6BrN3O5/c1-4-7(10)8(12-18-4)11-9(14)5-2-3-6(17-5)13(15)16/h2-3H,1H3,(H,11,12,14)
InChI Key ADOWXLLBBLZSCS-UHFFFAOYSA-N
Canonical SMILES CC1=C(C(=NO1)NC(=O)C2=CC=C(O2)[N+](=O)[O-])Br
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Other Names 2-Furancarboxamide, N-(4-bromo-5-methyl-3-isoxazolyl)-5-nitro-;
N-(4-Bromo-5-methyl-isoxazol-3-yl)-5-nitro-2-furamide

In Other Databases

PubChem 2799295
ChemSpider 2078033
ChEMBL CHEMBL1594702