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2'-[5-(2-Bromo-5-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-m-toluanilide

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2'-[5-(2-Bromo-5-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-m-toluanilide
SpectraBase Compound ID 6DAqian0dW5
InChI InChI=1S/C23H18BrN3O3/c1-14-6-5-7-15(12-14)21(28)25-20-9-4-3-8-17(20)22-26-27-23(30-22)18-13-16(29-2)10-11-19(18)24/h3-13H,1-2H3,(H,25,28)
InChIKey ALVYOCZYNXTJLH-UHFFFAOYSA-N
Mol Weight 464.32 g/mol
Molecular Formula C23H18BrN3O3
Exact Mass 463.053154 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BXTtl5DIpZk
Name 2'-[5-(2-Bromo-5-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-m-toluanilide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 463.053154449 u
Formula C23H18BrN3O3
InChI InChI=1S/C23H18BrN3O3/c1-14-6-5-7-15(12-14)21(28)25-20-9-4-3-8-17(20)22-26-27-23(30-22)18-13-16(29-2)10-11-19(18)24/h3-13H,1-2H3,(H,25,28)
InChIKey ALVYOCZYNXTJLH-UHFFFAOYSA-N
Molecular Weight 464.319 g/mol
SMILES N(C=1C=CC=CC1C1=NN=C(O1)C1=CC(=CC=C1Br)OC)C(=O)C=1C=CC=C(C1)C