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Hept-4-enoylamide, N-(2-butyl)-N-(3-methylbutyl)-

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

Hept-4-enoylamide, N-(2-butyl)-N-(3-methylbutyl)-
SpectraBase Compound ID GEUSZUL47jS
InChI InChI=1S/C16H31NO/c1-6-8-9-10-11-16(18)17(15(5)7-2)13-12-14(3)4/h8-9,14-15H,6-7,10-13H2,1-5H3/b9-8+
InChIKey GHFSDLXLWHIQAE-CMDGGOBGSA-N
Mol Weight 253.43 g/mol
Molecular Formula C16H31NO
Exact Mass 253.240565 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Cv311g0us2J
Name Hept-4-enoylamide, N-(2-butyl)-N-(3-methylbutyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 253.240564621 u
Formula C16H31NO
InChI InChI=1S/C16H31NO/c1-6-8-9-10-11-16(18)17(15(5)7-2)13-12-14(3)4/h8-9,14-15H,6-7,10-13H2,1-5H3/b9-8+
InChIKey GHFSDLXLWHIQAE-CMDGGOBGSA-N
Molecular Weight 253.430 g/mol
SMILES C(N(C(=O)CC\C=C\CC)C(CC)C)CC(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.873939