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2',4'-bis(o-Tolyloxy)-4-nitrobenzanilide

View entire compound with spectra: 2 NMR, and 1 FTIR

2',4'-bis(o-Tolyloxy)-4-nitrobenzanilide
SpectraBase Compound ID 9jW85xY5CF0
InChI InChI=1S/C27H22N2O5/c1-18-7-3-5-9-24(18)33-22-15-16-23(26(17-22)34-25-10-6-4-8-19(25)2)28-27(30)20-11-13-21(14-12-20)29(31)32/h3-17H,1-2H3,(H,28,30)
InChIKey KGHVFDRSUVVLFL-UHFFFAOYSA-N
Mol Weight 454.48 g/mol
Molecular Formula C27H22N2O5
Exact Mass 454.152872 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CPdNpQcAWIg
Name 2',4'-bis(o-Tolyloxy)-4-nitrobenzanilide
Comments Computed using HOSE algorithm
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Exact Mass 454.152871811 u
Formula C27H22N2O5
InChI InChI=1S/C27H22N2O5/c1-18-7-3-5-9-24(18)33-22-15-16-23(26(17-22)34-25-10-6-4-8-19(25)2)28-27(30)20-11-13-21(14-12-20)29(31)32/h3-17H,1-2H3,(H,28,30)
InChIKey KGHVFDRSUVVLFL-UHFFFAOYSA-N
Molecular Weight 454.482 g/mol
SMILES N(C1=C(C=C(C=C1)OC=1C(=CC=CC1)C)OC=1C=CC=CC1C)C(C1=CC=C(C=C1)N(=O)=O)=O