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benzoic acid, 4-methoxy-, 2-[(E)-(5-bromo-2-propoxyphenyl)methylidene]hydrazide
SpectraBase Compound ID BuaNFD9xYKs
InChI InChI=1S/C18H19BrN2O3/c1-3-10-24-17-9-6-15(19)11-14(17)12-20-21-18(22)13-4-7-16(23-2)8-5-13/h4-9,11-12H,3,10H2,1-2H3,(H,21,22)/b20-12+
InChIKey KEIOUHJJWMEPSL-UDWIEESQSA-N
Mol Weight 391.27 g/mol
Molecular Formula C18H19BrN2O3
Exact Mass 390.057905 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HaNfpDbXifm
Name Benzoic acid, 4-methoxy-, 2-[(E)-(5-bromo-2-propoxyphenyl)methylidene]hydrazide
Comments Computed using HOSE algorithm
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Exact Mass 390.057905477 u
Formula C18H19BrN2O3
InChI InChI=1S/C18H19BrN2O3/c1-3-10-24-17-9-6-15(19)11-14(17)12-20-21-18(22)13-4-7-16(23-2)8-5-13/h4-9,11-12H,3,10H2,1-2H3,(H,21,22)/b20-12+
InChIKey KEIOUHJJWMEPSL-UDWIEESQSA-N
Molecular Weight 391.265 g/mol
SMILES N(C(C1=CC=C(C=C1)OC)=O)\N=C\C1=C(C=CC(=C1)Br)OCCC