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1-(2-chlorobenzyl)-5-(4-chlorophenyl)-7-ethoxy-2,4-dioxo-1,2,3,4,5,8-hexahydropyrido[2,3-d]pyrimidine-6-carbonitrile
SpectraBase Compound ID HY4DsBt0XBz
InChI InChI=1S/C23H18Cl2N4O3/c1-2-32-22-16(11-26)18(13-7-9-15(24)10-8-13)19-20(27-22)29(23(31)28-21(19)30)12-14-5-3-4-6-17(14)25/h3-10,18,27H,2,12H2,1H3,(H,28,30,31)
InChIKey KCQFMQQFXHSBSO-UHFFFAOYSA-N
Mol Weight 469.33 g/mol
Molecular Formula C23H18Cl2N4O3
Exact Mass 468.075596 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LsISQ6KC2rx
Name 1-(2-chlorobenzyl)-5-(4-chlorophenyl)-7-ethoxy-2,4-dioxo-1,2,3,4,5,8-hexahydropyrido[2,3-d]pyrimidine-6-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 468.075595853 u
Formula C23H18Cl2N4O3
InChI InChI=1S/C23H18Cl2N4O3/c1-2-32-22-16(11-26)18(13-7-9-15(24)10-8-13)19-20(27-22)29(23(31)28-21(19)30)12-14-5-3-4-6-17(14)25/h3-10,18,27H,2,12H2,1H3,(H,28,30,31)
InChIKey KCQFMQQFXHSBSO-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP 5050A
Ionization Type EI
Literature Reference DOI 10.1016/j.arabjc.2021.103669
Molecular Weight 469.328 g/mol
Quality 230
SMILES N1C(N(C2=C(C(C(=C(N2)OCC)C#N)C2=CC=C(C=C2)Cl)C1=O)CC1=C(C=CC=C1)Cl)=O
SPLASH splash10-0229-8359500000-06438dfb3d394ff94ff8
Source of Spectrum AJC-15-16-16 (DOI: 10.1016/j.arabjc.2021.103669)
Wiley ID 1908047