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acetic acid, [4-(phenylmethoxy)phenoxy]-, 2-[(E)-(5-bromo-2-propoxyphenyl)methylidene]hydrazide
SpectraBase Compound ID 69BsqWGYpwi
InChI InChI=1S/C25H25BrN2O4/c1-2-14-30-24-13-8-21(26)15-20(24)16-27-28-25(29)18-32-23-11-9-22(10-12-23)31-17-19-6-4-3-5-7-19/h3-13,15-16H,2,14,17-18H2,1H3,(H,28,29)/b27-16+
InChIKey VGQNQEOYKLBXPI-JVWAILMASA-N
Mol Weight 497.39 g/mol
Molecular Formula C25H25BrN2O4
Exact Mass 496.09977 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LDaVXcJQbu8
Name Acetic acid, [4-(phenylmethoxy)phenoxy]-, 2-[(E)-(5-bromo-2-propoxyphenyl)methylidene]hydrazide
Comments Computed using HOSE algorithm
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Exact Mass 496.099770289 u
Formula C25H25BrN2O4
InChI InChI=1S/C25H25BrN2O4/c1-2-14-30-24-13-8-21(26)15-20(24)16-27-28-25(29)18-32-23-11-9-22(10-12-23)31-17-19-6-4-3-5-7-19/h3-13,15-16H,2,14,17-18H2,1H3,(H,28,29)/b27-16+
InChIKey VGQNQEOYKLBXPI-JVWAILMASA-N
Molecular Weight 497.389 g/mol
SMILES N(C(=O)COC=1C=CC(OCC2=CC=CC=C2)=CC1)\N=C\C=1C(=CC=C(C1)Br)OCCC