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Pent-4-enoylamide, 2-methyl-N-benzyl-N-butyl-

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Pent-4-enoylamide, 2-methyl-N-benzyl-N-butyl-
SpectraBase Compound ID 9BvBi9H6jPR
InChI InChI=1S/C17H25NO/c1-4-6-13-18(17(19)15(3)10-5-2)14-16-11-8-7-9-12-16/h5,7-9,11-12,15H,2,4,6,10,13-14H2,1,3H3
InChIKey LWKHRYSFCSPIGM-UHFFFAOYSA-N
Mol Weight 259.39 g/mol
Molecular Formula C17H25NO
Exact Mass 259.193614 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8lHrnLmI50B
Name Pent-4-enoylamide, 2-methyl-N-benzyl-N-butyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 259.193614428 u
Formula C17H25NO
InChI InChI=1S/C17H25NO/c1-4-6-13-18(17(19)15(3)10-5-2)14-16-11-8-7-9-12-16/h5,7-9,11-12,15H,2,4,6,10,13-14H2,1,3H3
InChIKey LWKHRYSFCSPIGM-UHFFFAOYSA-N
Molecular Weight 259.393 g/mol
SMILES C(N(CCCC)CC1=CC=CC=C1)(=O)C(CC=C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.867262