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Valeramide, 2-propyl-N-octadecyl-
SpectraBase Compound ID AjVsmJo2dUt
InChI InChI=1S/C26H53NO/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24-27-26(28)25(22-5-2)23-6-3/h25H,4-24H2,1-3H3,(H,27,28)
InChIKey DFHYBAZZTXUJPW-UHFFFAOYSA-N
Mol Weight 395.7 g/mol
Molecular Formula C26H53NO
Exact Mass 395.412715 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 66bjwIDDekO
Name Valeramide, 2-propyl-N-octadecyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 395.412715330 u
Formula C26H53NO
InChI InChI=1S/C26H53NO/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24-27-26(28)25(22-5-2)23-6-3/h25H,4-24H2,1-3H3,(H,27,28)
InChIKey DFHYBAZZTXUJPW-UHFFFAOYSA-N
Molecular Weight 395.716 g/mol
SMILES CCCC(C(NCCCCCCCCCCCCCCCCCC)=O)CCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.930128