| SpectraBase Compound ID | 9pvLODAU9LM |
|---|---|
| InChI | InChI=1S/C13H6ClN3O5/c14-8-6-10(17(19)20)12(11-7(8)2-1-4-15-11)22-13(18)9-3-5-21-16-9/h1-6H |
| InChIKey | YNRYABRRYZNTGA-UHFFFAOYSA-N |
| Mol Weight | 319.66 g/mol |
| Molecular Formula | C13H6ClN3O5 |
| Exact Mass | 318.999598 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 4tINPu1rl9g |
|---|---|
| Name | 3-Isoxazolecarboxylic acid, 5-chloro-7-nitro-8-quinolinyl ester |
| CAS Registry Number | 113607-98-0 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C13H6ClN3O5 |
| InChI | InChI=1S/C13H6ClN3O5/c14-8-6-10(17(19)20)12(11-7(8)2-1-4-15-11)22-13(18)9-3-5-21-16-9/h1-6H |
| InChIKey | YNRYABRRYZNTGA-UHFFFAOYSA-N |
| Instrument Name | Bruker IFS 85 |
| Purity | slightly contaminated |
| Technique | KBr-Pellet |