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Hexanamide, 3,5,5-trimethyl-N-benzyl-N-undecyl-

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Hexanamide, 3,5,5-trimethyl-N-benzyl-N-undecyl-
SpectraBase Compound ID 9p87UtJzFp3
InChI InChI=1S/C27H47NO/c1-6-7-8-9-10-11-12-13-17-20-28(23-25-18-15-14-16-19-25)26(29)21-24(2)22-27(3,4)5/h14-16,18-19,24H,6-13,17,20-23H2,1-5H3
InChIKey USOHNPKBRCNWCI-UHFFFAOYSA-N
Mol Weight 401.7 g/mol
Molecular Formula C27H47NO
Exact Mass 401.365765 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 87QkBXmZ5ux
Name Hexanamide, 3,5,5-trimethyl-N-benzyl-N-undecyl-
Comments Computed using HOSE algorithm
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Exact Mass 401.365765136 u
Formula C27H47NO
InChI InChI=1S/C27H47NO/c1-6-7-8-9-10-11-12-13-17-20-28(23-25-18-15-14-16-19-25)26(29)21-24(2)22-27(3,4)5/h14-16,18-19,24H,6-13,17,20-23H2,1-5H3
InChIKey USOHNPKBRCNWCI-UHFFFAOYSA-N
Molecular Weight 401.679 g/mol
SMILES C(N(CCCCCCCCCCC)CC1=CC=CC=C1)(=O)CC(C)CC(C)(C)C