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2-(N-(2-Benzamidobutyl)benzamido)butyl benzoate

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2-(N-(2-Benzamidobutyl)benzamido)butyl benzoate
SpectraBase Compound ID HnVnmGKf655
InChI InChI=1S/C29H32N2O4/c1-3-25(30-27(32)22-14-8-5-9-15-22)20-31(28(33)23-16-10-6-11-17-23)26(4-2)21-35-29(34)24-18-12-7-13-19-24/h5-19,25-26H,3-4,20-21H2,1-2H3,(H,30,32)
InChIKey FFEPJPIFTPFRCE-UHFFFAOYSA-N
Mol Weight 472.6 g/mol
Molecular Formula C29H32N2O4
Exact Mass 472.236208 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 10M3i9n3Qhw
Name 2-(N-(2-Benzamidobutyl)benzamido)butyl benzoate
Comments Computed using HOSE algorithm
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Exact Mass 472.236207514 u
Formula C29H32N2O4
InChI InChI=1S/C29H32N2O4/c1-3-25(30-27(32)22-14-8-5-9-15-22)20-31(28(33)23-16-10-6-11-17-23)26(4-2)21-35-29(34)24-18-12-7-13-19-24/h5-19,25-26H,3-4,20-21H2,1-2H3,(H,30,32)
InChIKey FFEPJPIFTPFRCE-UHFFFAOYSA-N
Molecular Weight 472.585 g/mol
SMILES C(=O)(N(CC(NC(C1=CC=CC=C1)=O)CC)C(COC(C1=CC=CC=C1)=O)CC)C1=CC=CC=C1