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Butyrylamide, 2-phenyl-N-benzyl-N-tetradecyl-
SpectraBase Compound ID 4KurKWa21xa
InChI InChI=1S/C31H47NO/c1-3-5-6-7-8-9-10-11-12-13-14-21-26-32(27-28-22-17-15-18-23-28)31(33)30(4-2)29-24-19-16-20-25-29/h15-20,22-25,30H,3-14,21,26-27H2,1-2H3
InChIKey QQROABMSFGLKFA-UHFFFAOYSA-N
Mol Weight 449.7 g/mol
Molecular Formula C31H47NO
Exact Mass 449.365765 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JrNKFddyZvd
Name Butyrylamide, 2-phenyl-N-benzyl-N-tetradecyl-
Comments Computed using HOSE algorithm
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Exact Mass 449.365765136 u
Formula C31H47NO
InChI InChI=1S/C31H47NO/c1-3-5-6-7-8-9-10-11-12-13-14-21-26-32(27-28-22-17-15-18-23-28)31(33)30(4-2)29-24-19-16-20-25-29/h15-20,22-25,30H,3-14,21,26-27H2,1-2H3
InChIKey QQROABMSFGLKFA-UHFFFAOYSA-N
Molecular Weight 449.723 g/mol
SMILES C(N(CCCCCCCCCCCCCC)CC1=CC=CC=C1)(=O)C(CC)C=1C=CC=CC1