9-Chloro-2-hydroxy-5-imino-4-oxo-3,5-dihydro-4H-chromeno[3,4-c]pyridine-1-carbonitrile

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Systematic / IUPAC Name: 9-Chloro-4-hydroxy-5-imino-2-oxo-3H-chromeno[3,4-c]pyridine-1-carbonitrile

ID: Reference8687

Other Names: 4H-[1]Benzopyrano[3,4-c]pyridine-1-carbonitrile, 9-chloro-3,5-dihydro-2-hydroxy-5-imino-4-oxo-;
Kinome_3721

Formula: C13H6ClN3O3

Spectral Data

9-Chloro-2-hydroxy-5-imino-4-oxo-3,5-dihydro-4H-chromeno[3,4-c]pyridine-1-carbonitrile 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 1
No. of Spectra 110
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/8/2019 8:52:52 AM
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Identificators

InChI InChI=1S/C13H6ClN3O3/c14-5-1-2-8-6(3-5)9-7(4-15)12(18)17-13(19)10(9)11(16)20-8/h1-3,16H,(H2,17,18,19)
InChI Key OKCNACDPDSQZSE-UHFFFAOYSA-N
Canonical SMILES C1=CC2=C(C=C1Cl)C3=C(C(=O)NC(=C3C(=N)O2)O)C#N
CAS
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Other Names 4H-[1]Benzopyrano[3,4-c]pyridine-1-carbonitrile, 9-chloro-3,5-dihydro-2-hydroxy-5-imino-4-oxo-;
Kinome_3721

In Other Databases

PubChem 397107
ChEMBL CHEMBL1973711
ChemSpider 17922972