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Isovaleramide, N-(2-butyl)-N-undecyl-

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

Isovaleramide, N-(2-butyl)-N-undecyl-
SpectraBase Compound ID 7MaEa9cK8BW
InChI InChI=1S/C20H41NO/c1-6-8-9-10-11-12-13-14-15-16-21(19(5)7-2)20(22)17-18(3)4/h18-19H,6-17H2,1-5H3
InChIKey HJTBPDASLFYIFC-UHFFFAOYSA-N
Mol Weight 311.6 g/mol
Molecular Formula C20H41NO
Exact Mass 311.318815 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1DSE1tnX6sY
Name Isovaleramide, N-(2-butyl)-N-undecyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 311.318814943 u
Formula C20H41NO
InChI InChI=1S/C20H41NO/c1-6-8-9-10-11-12-13-14-15-16-21(19(5)7-2)20(22)17-18(3)4/h18-19H,6-17H2,1-5H3
InChIKey HJTBPDASLFYIFC-UHFFFAOYSA-N
Molecular Weight 311.554 g/mol
SMILES C(N(CCCCCCCCCCC)C(CC)C)(=O)CC(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.929491