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benzoic acid, 3-[(4-fluorobenzoyl)amino]-, 2-[(E)-(3-bromophenyl)methylidene]hydrazide
SpectraBase Compound ID 2sY6Klos5MC
InChI InChI=1S/C21H15BrFN3O2/c22-17-5-1-3-14(11-17)13-24-26-21(28)16-4-2-6-19(12-16)25-20(27)15-7-9-18(23)10-8-15/h1-13H,(H,25,27)(H,26,28)/b24-13+
InChIKey UYAGJZSXCMJRDN-ZMOGYAJESA-N
Mol Weight 440.27 g/mol
Molecular Formula C21H15BrFN3O2
Exact Mass 439.033168 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2LaCIFQfBGJ
Name Benzoic acid, 3-[(4-fluorobenzoyl)amino]-, 2-[(E)-(3-bromophenyl)methylidene]hydrazide
Comments Computed using HOSE algorithm
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Exact Mass 439.033167896 u
Formula C21H15BrFN3O2
InChI InChI=1S/C21H15BrFN3O2/c22-17-5-1-3-14(11-17)13-24-26-21(28)16-4-2-6-19(12-16)25-20(27)15-7-9-18(23)10-8-15/h1-13H,(H,25,27)(H,26,28)/b24-13+
InChIKey UYAGJZSXCMJRDN-ZMOGYAJESA-N
Molecular Weight 440.272 g/mol
SMILES N(C(C1=CC=C(C=C1)F)=O)C=1C=C(C(N\N=C\C=2C=C(Br)C=CC2)=O)C=CC1