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2-cyano-2-[(4,6-dimethyl-1H-pyrazolo[3,4-b]pyridin-3-yl)-hydrazono]-N-(9,10-dioxo-9,10-dihydro-anthracen-2-yl)-acetamide
SpectraBase Compound ID DAOn2cYDs9b
InChI InChI=1S/C25H17N7O3/c1-12-9-13(2)27-23-20(12)24(32-30-23)31-29-19(11-26)25(35)28-14-7-8-17-18(10-14)22(34)16-6-4-3-5-15(16)21(17)33/h3-10H,1-2H3,(H,28,35)(H2,27,30,31,32)/b29-19+
InChIKey QWIIIOXHJNOYBO-VUTHCHCSSA-N
Mol Weight 463.46 g/mol
Molecular Formula C25H17N7O3
Exact Mass 463.139287 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID COybIfnPgpc
Name 2-cyano-2-[(4,6-dimethyl-1H-pyrazolo[3,4-b]pyridin-3-yl)-hydrazono]-N-(9,10-dioxo-9,10-dihydro-anthracen-2-yl)-acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H17N7O3
InChI InChI=1S/C25H17N7O3/c1-12-9-13(2)27-23-20(12)24(32-30-23)31-29-19(11-26)25(35)28-14-7-8-17-18(10-14)22(34)16-6-4-3-5-15(16)21(17)33/h3-10H,1-2H3,(H,28,35)(H2,27,30,31,32)/b29-19+
InChIKey QWIIIOXHJNOYBO-VUTHCHCSSA-N
Molecular Weight 463.457 g/mol
SMILES N(\N=C\(C(Nc1cc2C(c3ccccc3C(c2cc1)=O)=O)=O)C#N)c1n[nH]c2c1c(cc(n2)C)C
SPLASH splash10-03e9-0900100000-745e1614b5d7b3f07670
Source of Spectrum F2-45-1848-13
Wiley ID 1688954