For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Methyl 3-(4-Chlorophenyl)-5-cyano-6,7-dihydro-6-oxo-1H-pyrazolo[3,4-b]pyridine-4-carboxylate
SpectraBase Compound ID B53Gp1f8c5q
InChI InChI=1S/C15H9ClN4O3/c1-23-15(22)10-9(6-17)14(21)18-13-11(10)12(19-20-13)7-2-4-8(16)5-3-7/h2-5H,1H3,(H2,18,19,20,21)
InChIKey WJUKZMGIAAAFJX-UHFFFAOYSA-N
Mol Weight 328.72 g/mol
Molecular Formula C15H9ClN4O3
Exact Mass 328.036318 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID IOplFWwq8vX
Name Methyl 3-(4-Chlorophenyl)-5-cyano-6,7-dihydro-6-oxo-1H-pyrazolo[3,4-b]pyridine-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H9ClN4O3
InChI InChI=1S/C15H9ClN4O3/c1-23-15(22)10-9(6-17)14(21)18-13-11(10)12(19-20-13)7-2-4-8(16)5-3-7/h2-5H,1H3,(H2,18,19,20,21)
InChIKey WJUKZMGIAAAFJX-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201200633
Molecular Weight 328.715 g/mol
SMILES [nH]1c2c(C(=C(C(=O)N2)C#N)C(=O)OC)c(n1)-c1ccc(cc1)Cl
SPLASH splash10-002r-2903000000-db766f4a267771588326
Source of Spectrum H-96-640-10g
Synonyms Methyl 3-(4-chlorophenyl)-5-cyano-6-oxo-6,7-dihydro-1H-pyrazolo[3,4-b]pyridine-4-carboxylate
Wiley ID 1784714