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2-(4-chlorophenyl)-3-{2-[2-(2,4,6-trichlorophenoxy)ethoxy]ethyl}-4(3H)-quinazolinone
SpectraBase Compound ID 2EL8plw0nEn
InChI InChI=1S/C24H18Cl4N2O3/c25-16-7-5-15(6-8-16)23-29-21-4-2-1-3-18(21)24(31)30(23)9-10-32-11-12-33-22-19(27)13-17(26)14-20(22)28/h1-8,13-14H,9-12H2
InChIKey SFAKRBMMIPJRRN-UHFFFAOYSA-N
Mol Weight 524.2 g/mol
Molecular Formula C24H18Cl4N2O3
Exact Mass 522.007153 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2NiSslEKXFr
Name 2-(4-Chlorophenyl)-3-{2-[2-(2,4,6-trichlorophenoxy)ethoxy]ethyl}-4(3H)-quinazolinone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 522.007153245 u
Formula C24H18Cl4N2O3
InChI InChI=1S/C24H18Cl4N2O3/c25-16-7-5-15(6-8-16)23-29-21-4-2-1-3-18(21)24(31)30(23)9-10-32-11-12-33-22-19(27)13-17(26)14-20(22)28/h1-8,13-14H,9-12H2
InChIKey SFAKRBMMIPJRRN-UHFFFAOYSA-N
Molecular Weight 524.231 g/mol
SMILES C=1C=CC=2C(N(C(=NC2C1)C=1C=CC(=CC1)Cl)CCOCCOC1=C(C=C(C=C1Cl)Cl)Cl)=O