SpectraBase Compound ID | JiIYFpSrMKj |
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InChI | InChI=1S/C13H6BrN3O5/c14-8-6-10(17(19)20)7-2-1-4-15-11(7)12(8)22-13(18)9-3-5-21-16-9/h1-6H |
InChIKey | ZQLDIKOKBNZIPY-UHFFFAOYSA-N |
Mol Weight | 364.11 g/mol |
Molecular Formula | C13H6BrN3O5 |
Exact Mass | 362.949083 g/mol |
SpectraBase Spectrum ID | ERDynpF61R2 |
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Name | 3-Isoxazolecarboxylic acid, 7-bromo-5-nitro-8-quinolinyl ester |
CAS Registry Number | 113607-88-8 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C13H6BrN3O5 |
InChI | InChI=1S/C13H6BrN3O5/c14-8-6-10(17(19)20)7-2-1-4-15-11(7)12(8)22-13(18)9-3-5-21-16-9/h1-6H |
InChIKey | ZQLDIKOKBNZIPY-UHFFFAOYSA-N |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |