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N'-((E)-{3-[(4-bromobenzyl)oxy]-4-methoxyphenyl}methylidene)benzenesulfonohydrazide

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N'-((E)-{3-[(4-bromobenzyl)oxy]-4-methoxyphenyl}methylidene)benzenesulfonohydrazide
SpectraBase Compound ID 1izwg0OxCpy
InChI InChI=1S/C21H19BrN2O4S/c1-27-20-12-9-17(13-21(20)28-15-16-7-10-18(22)11-8-16)14-23-24-29(25,26)19-5-3-2-4-6-19/h2-14,24H,15H2,1H3/b23-14+
InChIKey NFZVKVDBGBCSQO-OEAKJJBVSA-N
Mol Weight 475.36 g/mol
Molecular Formula C21H19BrN2O4S
Exact Mass 474.024891 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5o9BlboCk51
Name N'-((E)-{3-[(4-bromobenzyl)oxy]-4-methoxyphenyl}methylidene)benzenesulfonohydrazide
Comments Computed using HOSE algorithm
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Exact Mass 474.024891270 u
Formula C21H19BrN2O4S
InChI InChI=1S/C21H19BrN2O4S/c1-27-20-12-9-17(13-21(20)28-15-16-7-10-18(22)11-8-16)14-23-24-29(25,26)19-5-3-2-4-6-19/h2-14,24H,15H2,1H3/b23-14+
InChIKey NFZVKVDBGBCSQO-OEAKJJBVSA-N
Molecular Weight 475.357 g/mol
SMILES N(S(=O)(=O)C1=CC=CC=C1)\N=C\C1=CC(OCC2=CC=C(C=C2)Br)=C(C=C1)OC