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Octadecanamide, N-pentyl-

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

Octadecanamide, N-pentyl-
SpectraBase Compound ID D66X3uFWoLH
InChI InChI=1S/C23H47NO/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-21-23(25)24-22-20-6-4-2/h3-22H2,1-2H3,(H,24,25)
InChIKey BNMNWSJQGWRNAD-UHFFFAOYSA-N
Mol Weight 353.6 g/mol
Molecular Formula C23H47NO
Exact Mass 353.365765 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID AWeoiQvNyaJ
Name Octadecanamide, N-pentyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 353.365765136 u
Formula C23H47NO
InChI InChI=1S/C23H47NO/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-21-23(25)24-22-20-6-4-2/h3-22H2,1-2H3,(H,24,25)
InChIKey BNMNWSJQGWRNAD-UHFFFAOYSA-N
Molecular Weight 353.635 g/mol
SMILES C(CCCCCCCCCCCCCCCC)C(NCCCCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.903556