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(6-Dichloromethyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-5-yl)-(2-hydroxy-phenyl)-methanone
SpectraBase Compound ID 535izEDh8Oh
InChI InChI=1S/C21H15Cl2N3O2/c1-12-15-11-16(19(28)14-9-5-6-10-17(14)27)18(20(22)23)24-21(15)26(25-12)13-7-3-2-4-8-13/h2-11,20,27H,1H3
InChIKey JRSAYCRUPOQAPY-UHFFFAOYSA-N
Mol Weight 412.28 g/mol
Molecular Formula C21H15Cl2N3O2
Exact Mass 411.054132 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B9gpfZGhDFY
Name (6-Dichloromethyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-5-yl)-(2-hydroxy-phenyl)-methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15Cl2N3O2
InChI InChI=1S/C21H15Cl2N3O2/c1-12-15-11-16(19(28)14-9-5-6-10-17(14)27)18(20(22)23)24-21(15)26(25-12)13-7-3-2-4-8-13/h2-11,20,27H,1H3
InChIKey JRSAYCRUPOQAPY-UHFFFAOYSA-N
Molecular Weight 412.276 g/mol
SMILES Oc1c(C(c2c(nc3[n](nc(c3c2)C)-c2ccccc2)C(Cl)Cl)=O)cccc1
SPLASH splash10-01tc-1119400000-bbbb9a1780bc4bd9d24b
Source of Spectrum F4-43-475-24g
Synonyms 6-(Dichloromethyl)-5-salicyloyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine
Wiley ID 1711952