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Pent-4-enoylamide, 2-methyl-N-propyl-N-octadecyl-

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

Pent-4-enoylamide, 2-methyl-N-propyl-N-octadecyl-
SpectraBase Compound ID F6UcyI0NNTU
InChI InChI=1S/C27H53NO/c1-5-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25-28(24-7-3)27(29)26(4)23-6-2/h6,26H,2,5,7-25H2,1,3-4H3
InChIKey KLOKJXVKMNIANS-UHFFFAOYSA-N
Mol Weight 407.7 g/mol
Molecular Formula C27H53NO
Exact Mass 407.412715 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CVCIQUo5iWL
Name Pent-4-enoylamide, 2-methyl-N-propyl-N-octadecyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 407.412715330 u
Formula C27H53NO
InChI InChI=1S/C27H53NO/c1-5-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25-28(24-7-3)27(29)26(4)23-6-2/h6,26H,2,5,7-25H2,1,3-4H3
InChIKey KLOKJXVKMNIANS-UHFFFAOYSA-N
Molecular Weight 407.727 g/mol
SMILES C(N(CCC)CCCCCCCCCCCCCCCCCC)(=O)C(CC=C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.903287