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4-[(2E)-2-(9-Anthrylmethylene)hydrazino]-N-(2-bromophenyl)-4-oxobutanamide

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4-[(2E)-2-(9-Anthrylmethylene)hydrazino]-N-(2-bromophenyl)-4-oxobutanamide
SpectraBase Compound ID LDR93KDDxBt
InChI InChI=1S/C25H20BrN3O2/c26-22-11-5-6-12-23(22)28-24(30)13-14-25(31)29-27-16-21-19-9-3-1-7-17(19)15-18-8-2-4-10-20(18)21/h1-12,15-16H,13-14H2,(H,28,30)(H,29,31)
InChIKey XSYRTMJISFAMQY-UHFFFAOYSA-N
Mol Weight 474.36 g/mol
Molecular Formula C25H20BrN3O2
Exact Mass 473.07389 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IsHBbgqo5sZ
Name 4-[(2E)-2-(9-Anthrylmethylene)hydrazino]-N-(2-bromophenyl)-4-oxobutanamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 473.073889894 u
Formula C25H20BrN3O2
InChI InChI=1S/C25H20BrN3O2/c26-22-11-5-6-12-23(22)28-24(30)13-14-25(31)29-27-16-21-19-9-3-1-7-17(19)15-18-8-2-4-10-20(18)21/h1-12,15-16H,13-14H2,(H,28,30)(H,29,31)
InChIKey XSYRTMJISFAMQY-UHFFFAOYSA-N
Molecular Weight 474.358 g/mol
SMILES C1=CC=C2C(=C1)C=C1C(=C2C=NNC(=O)CCC(=O)NC2=C(C=CC=C2)Br)C=CC=C1