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Acetamide, 2-(4-nitrophenyl)-N-benzyl-N-octyl-
SpectraBase Compound ID DdctcG7r4bp
InChI InChI=1S/C23H30N2O3/c1-2-3-4-5-6-10-17-24(19-21-11-8-7-9-12-21)23(26)18-20-13-15-22(16-14-20)25(27)28/h7-9,11-16H,2-6,10,17-19H2,1H3
InChIKey QBIHVUASXGASGQ-UHFFFAOYSA-N
Mol Weight 382.5 g/mol
Molecular Formula C23H30N2O3
Exact Mass 382.225643 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F5VXGrpz82P
Name Acetamide, 2-(4-nitrophenyl)-N-benzyl-N-octyl-
Comments Computed using HOSE algorithm
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Exact Mass 382.225642831 u
Formula C23H30N2O3
InChI InChI=1S/C23H30N2O3/c1-2-3-4-5-6-10-17-24(19-21-11-8-7-9-12-21)23(26)18-20-13-15-22(16-14-20)25(27)28/h7-9,11-16H,2-6,10,17-19H2,1H3
InChIKey QBIHVUASXGASGQ-UHFFFAOYSA-N
Molecular Weight 382.504 g/mol
SMILES C(N(CCCCCCCC)CC1=CC=CC=C1)(=O)CC=1C=CC(=CC1)N(=O)=O