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1-Cyano-2-(p-fluorophenylamino)-7-benzoylpyrazolo[1',5':1,2]imidazolo[4,5-b]quinoxaline

View entire compound with spectra: 1 MS (GC)

1-Cyano-2-(p-fluorophenylamino)-7-benzoylpyrazolo[1',5':1,2]imidazolo[4,5-b]quinoxaline
SpectraBase Compound ID EzPumlUwbI8
InChI InChI=1S/C25H14FN7O/c26-16-7-9-17(10-8-16)28-22-18(13-27)24-31-23-25(33(24)32-22)30-20-12-15(6-11-19(20)29-23)21(34)14-4-2-1-3-5-14/h1-12H,(H,28,32)(H,29,31)
InChIKey NSQVGOHKXNRSJQ-UHFFFAOYSA-N
Mol Weight 447.43 g/mol
Molecular Formula C25H14FN7O
Exact Mass 447.124386 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KYu22TroXpT
Name 1-Cyano-2-(p-fluorophenylamino)-7-benzoylpyrazolo[1',5':1,2]imidazolo[4,5-b]quinoxaline
Alternate Name(s) 8-benzoyl-2-(4-fluoroanilino)-4H-pyrazolo[1',5':1,2]imidazo[4,5-b]quinoxaline-3-carbonitrile
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H14FN7O
InChI InChI=1S/C25H14FN7O/c26-16-7-9-17(10-8-16)28-22-18(13-27)24-31-23-25(33(24)32-22)30-20-12-15(6-11-19(20)29-23)21(34)14-4-2-1-3-5-14/h1-12H,(H,28,32)(H,29,31)
InChIKey NSQVGOHKXNRSJQ-UHFFFAOYSA-N
Molecular Weight 447.433 g/mol
SMILES N(c1n[n]-2c(c1C#N)Nc1c2nc2c(n1)ccc(c2)C(=O)c1ccccc1)c1ccc(cc1)F
SPLASH splash10-0006-0090000000-5825fc58d2a93080f9c9
Source of Spectrum Y1-40-200-10
Wiley ID 1528135