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Pent-4-enoylamide, 2-methyl-N-benzyl-N-(3-methylbutyl)-

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

Pent-4-enoylamide, 2-methyl-N-benzyl-N-(3-methylbutyl)-
SpectraBase Compound ID 87rkiYru97k
InChI InChI=1S/C18H27NO/c1-5-9-16(4)18(20)19(13-12-15(2)3)14-17-10-7-6-8-11-17/h5-8,10-11,15-16H,1,9,12-14H2,2-4H3
InChIKey NWPNWXWCWJXYML-UHFFFAOYSA-N
Mol Weight 273.42 g/mol
Molecular Formula C18H27NO
Exact Mass 273.209264 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CrA8wD3U3GA
Name Pent-4-enoylamide, 2-methyl-N-benzyl-N-(3-methylbutyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 273.209264492 u
Formula C18H27NO
InChI InChI=1S/C18H27NO/c1-5-9-16(4)18(20)19(13-12-15(2)3)14-17-10-7-6-8-11-17/h5-8,10-11,15-16H,1,9,12-14H2,2-4H3
InChIKey NWPNWXWCWJXYML-UHFFFAOYSA-N
Molecular Weight 273.420 g/mol
SMILES C(N(CCC(C)C)CC1=CC=CC=C1)(=O)C(CC=C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.81637