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3,5,5-Trimethylhexanamide, N-(2-phenylethyl)-N-octyl-

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

3,5,5-Trimethylhexanamide, N-(2-phenylethyl)-N-octyl-
SpectraBase Compound ID 5S8sb5BgpT0
InChI InChI=1S/C25H43NO/c1-6-7-8-9-10-14-18-26(19-17-23-15-12-11-13-16-23)24(27)20-22(2)21-25(3,4)5/h11-13,15-16,22H,6-10,14,17-21H2,1-5H3
InChIKey DCMYMQRIXOBONA-UHFFFAOYSA-N
Mol Weight 373.6 g/mol
Molecular Formula C25H43NO
Exact Mass 373.334465 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Fht6DnRCjU2
Name 3,5,5-Trimethylhexanamide, N-(2-phenylethyl)-N-octyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 373.334465008 u
Formula C25H43NO
InChI InChI=1S/C25H43NO/c1-6-7-8-9-10-14-18-26(19-17-23-15-12-11-13-16-23)24(27)20-22(2)21-25(3,4)5/h11-13,15-16,22H,6-10,14,17-21H2,1-5H3
InChIKey DCMYMQRIXOBONA-UHFFFAOYSA-N
Molecular Weight 373.625 g/mol
SMILES C(CC(CC(N(CCCCCCCC)CCC1=CC=CC=C1)=O)C)(C)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.920261