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N-[3-(1,3-benzoxazol-2-yl)phenyl]-N-[(E,2E)-3-(4-bromophenyl)-2-propenylidene]amine
SpectraBase Compound ID EwVD3PvFp8v
InChI InChI=1S/C22H15BrN2O/c23-18-12-10-16(11-13-18)5-4-14-24-19-7-3-6-17(15-19)22-25-20-8-1-2-9-21(20)26-22/h1-15H/b5-4+,24-14+
InChIKey FTJNKMIPBWPXJL-BAQHSMLZSA-N
Mol Weight 403.28 g/mol
Molecular Formula C22H15BrN2O
Exact Mass 402.036776 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3Rv37viQ22l
Name N-[3-(1,3-Benzoxazol-2-yl)phenyl]-N-[(E,2E)-3-(4-bromophenyl)-2-propenylidene]amine
Comments Computed using HOSE algorithm
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Exact Mass 402.036776110 u
Formula C22H15BrN2O
InChI InChI=1S/C22H15BrN2O/c23-18-12-10-16(11-13-18)5-4-14-24-19-7-3-6-17(15-19)22-25-20-8-1-2-9-21(20)26-22/h1-15H/b5-4+,24-14+
InChIKey FTJNKMIPBWPXJL-BAQHSMLZSA-N
Molecular Weight 403.279 g/mol
SMILES C1(=NC=2C=CC=CC2O1)C=1C=C(\N=C\C=C\C2=CC=C(C=C2)Br)C=CC1