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

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

3,5,5-Trimethylhexanamide, N-(2-phenylethyl)-N-ethyl-
SpectraBase Compound ID L7BaVbOhgg
InChI InChI=1S/C19H31NO/c1-6-20(13-12-17-10-8-7-9-11-17)18(21)14-16(2)15-19(3,4)5/h7-11,16H,6,12-15H2,1-5H3
InChIKey LHHIEIMEOQCQEM-UHFFFAOYSA-N
Mol Weight 289.46 g/mol
Molecular Formula C19H31NO
Exact Mass 289.240565 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3iIv1Bf5JlA
Name 3,5,5-Trimethylhexanamide, N-(2-phenylethyl)-N-ethyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 289.240564621 u
Formula C19H31NO
InChI InChI=1S/C19H31NO/c1-6-20(13-12-17-10-8-7-9-11-17)18(21)14-16(2)15-19(3,4)5/h7-11,16H,6,12-15H2,1-5H3
InChIKey LHHIEIMEOQCQEM-UHFFFAOYSA-N
Molecular Weight 289.463 g/mol
SMILES C(CC(CC(N(CC)CCC1=CC=CC=C1)=O)C)(C)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.884781