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1-Benzyl-5-chloro-3-{2-[(4-methoxyphenyl)ethynyl]anilino}-2(1H)-pyrazinone
SpectraBase Compound ID 2KleRL72WU2
InChI InChI=1S/C26H20ClN3O2/c1-32-22-15-12-19(13-16-22)11-14-21-9-5-6-10-23(21)28-25-26(31)30(18-24(27)29-25)17-20-7-3-2-4-8-20/h2-10,12-13,15-16,18H,17H2,1H3,(H,28,29)
InChIKey LGHBCSVEKSQFOD-UHFFFAOYSA-N
Mol Weight 441.92 g/mol
Molecular Formula C26H20ClN3O2
Exact Mass 441.124405 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gd1gdw3Rkgw
Name 1-Benzyl-5-chloro-3-{2-[(4-methoxyphenyl)ethynyl]anilino}-2(1H)-pyrazinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H20ClN3O2
InChI InChI=1S/C26H20ClN3O2/c1-32-22-15-12-19(13-16-22)11-14-21-9-5-6-10-23(21)28-25-26(31)30(18-24(27)29-25)17-20-7-3-2-4-8-20/h2-10,12-13,15-16,18H,17H2,1H3,(H,28,29)
InChIKey LGHBCSVEKSQFOD-UHFFFAOYSA-N
Molecular Weight 441.918 g/mol
SMILES N(C1=NC(Cl)=CN(C1=O)Cc1ccccc1)c1c(C#Cc2ccc(cc2)OC)cccc1
SPLASH splash10-0006-3000900000-730ae0ec3302372c3608
Source of Spectrum F-55-14680-1
Wiley ID 840146