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2-{4-[(2,4-Dichlorobenzyl)oxy]phenyl}quinoxaline
SpectraBase Compound ID 3wYL4fDS7UO
InChI InChI=1S/C21H14Cl2N2O/c22-16-8-5-15(18(23)11-16)13-26-17-9-6-14(7-10-17)21-12-24-19-3-1-2-4-20(19)25-21/h1-12H,13H2
InChIKey BRZGUMQSQPPKII-UHFFFAOYSA-N
Mol Weight 381.26 g/mol
Molecular Formula C21H14Cl2N2O
Exact Mass 380.048318 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LwvZ5kh7Cen
Name 2-{4-[(2,4-Dichlorobenzyl)oxy]phenyl}quinoxaline
Comments Computed using HOSE algorithm
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Exact Mass 380.048318478 u
Formula C21H14Cl2N2O
InChI InChI=1S/C21H14Cl2N2O/c22-16-8-5-15(18(23)11-16)13-26-17-9-6-14(7-10-17)21-12-24-19-3-1-2-4-20(19)25-21/h1-12H,13H2
InChIKey BRZGUMQSQPPKII-UHFFFAOYSA-N
Molecular Weight 381.262 g/mol
SMILES C1=CC=C2N=C(C=NC2=C1)C=1C=CC(OCC2=C(C=C(C=C2)Cl)Cl)=CC1