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2-[4-(2-Chloro-4-methylphenoxy)-2-quinazolinyl]phenol

View entire compound with spectra: 2 NMR

2-[4-(2-Chloro-4-methylphenoxy)-2-quinazolinyl]phenol
SpectraBase Compound ID 1FJvEzr4VF9
InChI InChI=1S/C21H15ClN2O2/c1-13-10-11-19(16(22)12-13)26-21-14-6-2-4-8-17(14)23-20(24-21)15-7-3-5-9-18(15)25/h2-12,25H,1H3
InChIKey FVQTXOCYXYZNJM-UHFFFAOYSA-N
Mol Weight 362.82 g/mol
Molecular Formula C21H15ClN2O2
Exact Mass 362.082205 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9e3w3O2bHcZ
Name 2-[4-(2-Chloro-4-methylphenoxy)-2-quinazolinyl]phenol
Comments Computed using HOSE algorithm
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Exact Mass 362.082205429 u
Formula C21H15ClN2O2
InChI InChI=1S/C21H15ClN2O2/c1-13-10-11-19(16(22)12-13)26-21-14-6-2-4-8-17(14)23-20(24-21)15-7-3-5-9-18(15)25/h2-12,25H,1H3
InChIKey FVQTXOCYXYZNJM-UHFFFAOYSA-N
Molecular Weight 362.816 g/mol
SMILES OC1=C(C=2N=C(OC3=C(C=C(C=C3)C)Cl)C=3C(N2)=CC=CC3)C=CC=C1