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2-Phenylbutanamide, N-(2-phenylethyl)-N-nonyl-

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2-Phenylbutanamide, N-(2-phenylethyl)-N-nonyl-
SpectraBase Compound ID FcDEG7WJLUi
InChI InChI=1S/C27H39NO/c1-3-5-6-7-8-9-16-22-28(23-21-24-17-12-10-13-18-24)27(29)26(4-2)25-19-14-11-15-20-25/h10-15,17-20,26H,3-9,16,21-23H2,1-2H3
InChIKey FWILNNAATWMKMC-UHFFFAOYSA-N
Mol Weight 393.6 g/mol
Molecular Formula C27H39NO
Exact Mass 393.303165 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Elpksb4QwSE
Name 2-Phenylbutanamide, N-(2-phenylethyl)-N-nonyl-
Comments Computed using HOSE algorithm
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Exact Mass 393.303164879 u
Formula C27H39NO
InChI InChI=1S/C27H39NO/c1-3-5-6-7-8-9-16-22-28(23-21-24-17-12-10-13-18-24)27(29)26(4-2)25-19-14-11-15-20-25/h10-15,17-20,26H,3-9,16,21-23H2,1-2H3
InChIKey FWILNNAATWMKMC-UHFFFAOYSA-N
Molecular Weight 393.615 g/mol
SMILES CCC(C(=O)N(CCCCCCCCC)CCC1=CC=CC=C1)C1=CC=CC=C1