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Butyramide, 4-phenyl-N-(2-pentyl)-N-hexadecyl-

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

Butyramide, 4-phenyl-N-(2-pentyl)-N-hexadecyl-
SpectraBase Compound ID wZBtiPHD9i
InChI InChI=1S/C31H55NO/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-21-28-32(29(3)23-5-2)31(33)27-22-26-30-24-19-18-20-25-30/h18-20,24-25,29H,4-17,21-23,26-28H2,1-3H3
InChIKey DXMBXRDMAXBALU-UHFFFAOYSA-N
Mol Weight 457.8 g/mol
Molecular Formula C31H55NO
Exact Mass 457.428365 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hc6XPA9YAGt
Name Butyramide, 4-phenyl-N-(2-pentyl)-N-hexadecyl-
Comments Computed using HOSE algorithm
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Exact Mass 457.428365394 u
Formula C31H55NO
InChI InChI=1S/C31H55NO/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-21-28-32(29(3)23-5-2)31(33)27-22-26-30-24-19-18-20-25-30/h18-20,24-25,29H,4-17,21-23,26-28H2,1-3H3
InChIKey DXMBXRDMAXBALU-UHFFFAOYSA-N
Molecular Weight 457.787 g/mol
SMILES CCCC(N(C(=O)CCCC=1C=CC=CC1)CCCCCCCCCCCCCCCC)C