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N-Benzoyl-4-bromo-N-(5-bromo-2-phenylbenzofuran-3-yl)-benzamide
SpectraBase Compound ID ITOhsEMRimo
InChI InChI=1S/C28H17Br2NO3/c29-21-13-11-20(12-14-21)28(33)31(27(32)19-9-5-2-6-10-19)25-23-17-22(30)15-16-24(23)34-26(25)18-7-3-1-4-8-18/h1-17H
InChIKey ZAEVUDJEYMVBBU-UHFFFAOYSA-N
Mol Weight 575.26 g/mol
Molecular Formula C28H17Br2NO3
Exact Mass 572.957519 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9J0rJT3eMnU
Name N-Benzoyl-4-bromo-N-(5-bromo-2-phenylbenzofuran-3-yl)-benzamide
Comments Computed using HOSE algorithm
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Exact Mass 572.957519408 u
Formula C28H17Br2NO3
InChI InChI=1S/C28H17Br2NO3/c29-21-13-11-20(12-14-21)28(33)31(27(32)19-9-5-2-6-10-19)25-23-17-22(30)15-16-24(23)34-26(25)18-7-3-1-4-8-18/h1-17H
InChIKey ZAEVUDJEYMVBBU-UHFFFAOYSA-N
Molecular Weight 575.256 g/mol
SMILES C=1(C=C2C(N(C(C3=CC=CC=C3)=O)C(=O)C3=CC=C(C=C3)Br)=C(OC2=CC1)C1=CC=CC=C1)Br