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

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

Hexanamide, 3,5,5-trimethyl-N-benzyl-N-pentyl-
SpectraBase Compound ID Ue7ijIgMnW
InChI InChI=1S/C21H35NO/c1-6-7-11-14-22(17-19-12-9-8-10-13-19)20(23)15-18(2)16-21(3,4)5/h8-10,12-13,18H,6-7,11,14-17H2,1-5H3
InChIKey LYOLPVHTVCIDRV-UHFFFAOYSA-N
Mol Weight 317.5 g/mol
Molecular Formula C21H35NO
Exact Mass 317.271865 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 80ArSBPHK6p
Name Hexanamide, 3,5,5-trimethyl-N-benzyl-N-pentyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 317.271864750 u
Formula C21H35NO
InChI InChI=1S/C21H35NO/c1-6-7-11-14-22(17-19-12-9-8-10-13-19)20(23)15-18(2)16-21(3,4)5/h8-10,12-13,18H,6-7,11,14-17H2,1-5H3
InChIKey LYOLPVHTVCIDRV-UHFFFAOYSA-N
Molecular Weight 317.517 g/mol
SMILES C(N(CCCCC)CC1=CC=CC=C1)(=O)CC(C)CC(C)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.888139