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2-(4-bromophenyl)-2-oxoethyl 2-{(E)-[4-(dimethylamino)phenyl]diazenyl}benzoate

View entire compound with spectra: 2 NMR

2-(4-bromophenyl)-2-oxoethyl 2-{(E)-[4-(dimethylamino)phenyl]diazenyl}benzoate
SpectraBase Compound ID KVBglB7xESH
InChI InChI=1S/C23H20BrN3O3/c1-27(2)19-13-11-18(12-14-19)25-26-21-6-4-3-5-20(21)23(29)30-15-22(28)16-7-9-17(24)10-8-16/h3-14H,15H2,1-2H3/b26-25+
InChIKey URVFWKHKPYIFBU-OCEACIFDSA-N
Mol Weight 466.34 g/mol
Molecular Formula C23H20BrN3O3
Exact Mass 465.068805 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C3gyR3mlEq8
Name 2-(4-Bromophenyl)-2-oxoethyl 2-{(E)-[4-(dimethylamino)phenyl]diazenyl}benzoate
Comments Computed using HOSE algorithm
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Exact Mass 465.068804513 u
Formula C23H20BrN3O3
InChI InChI=1S/C23H20BrN3O3/c1-27(2)19-13-11-18(12-14-19)25-26-21-6-4-3-5-20(21)23(29)30-15-22(28)16-7-9-17(24)10-8-16/h3-14H,15H2,1-2H3/b26-25+
InChIKey URVFWKHKPYIFBU-OCEACIFDSA-N
Molecular Weight 466.335 g/mol
SMILES C=1(C(OCC(C2=CC=C(C=C2)Br)=O)=O)C(\N=N\C=2C=CC(=CC2)N(C)C)=CC=CC1