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7-Cyano-2-ethoxy-3-(4-fluorophenyl)-5-phenyl-3H-pyrrolo[3,2-d]pyrimidine-4(5H)-one
SpectraBase Compound ID ARENyIEiJsz
InChI InChI=1S/C21H15FN4O2/c1-2-28-21-24-18-14(12-23)13-25(16-6-4-3-5-7-16)19(18)20(27)26(21)17-10-8-15(22)9-11-17/h3-11,13H,2H2,1H3
InChIKey UQZQDLSAXKREJA-UHFFFAOYSA-N
Mol Weight 374.38 g/mol
Molecular Formula C21H15FN4O2
Exact Mass 374.117904 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FLMqthAbjvn
Name 7-Cyano-2-ethoxy-3-(4-fluorophenyl)-5-phenyl-3H-pyrrolo[3,2-d]pyrimidine-4(5H)-one
Alternate Name(s) 2-Ethoxy-3-(4-fluorophenyl)-4-oxo-5-phenyl-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidine-7-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15FN4O2
InChI InChI=1S/C21H15FN4O2/c1-2-28-21-24-18-14(12-23)13-25(16-6-4-3-5-7-16)19(18)20(27)26(21)17-10-8-15(22)9-11-17/h3-11,13H,2H2,1H3
InChIKey UQZQDLSAXKREJA-UHFFFAOYSA-N
Molecular Weight 374.375 g/mol
SMILES c12c(N=C(N(C2=O)c2ccc(cc2)F)OCC)c(C#N)c[n]1-c1ccccc1
SPLASH splash10-0zos-1579000000-e2111f9adc86ed158f1d
Source of Spectrum Y-51-E96-6r
Wiley ID 1742228