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Hexanamide, 3,5,5-trimethyl-N-benzyl-N-propyl-

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Hexanamide, 3,5,5-trimethyl-N-benzyl-N-propyl-
SpectraBase Compound ID G8yBlGkLrQL
InChI InChI=1S/C19H31NO/c1-6-12-20(15-17-10-8-7-9-11-17)18(21)13-16(2)14-19(3,4)5/h7-11,16H,6,12-15H2,1-5H3
InChIKey XZZKCBMLECGUMV-UHFFFAOYSA-N
Mol Weight 289.46 g/mol
Molecular Formula C19H31NO
Exact Mass 289.240565 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3RMmpo711bM
Name Hexanamide, 3,5,5-trimethyl-N-benzyl-N-propyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 289.240564621 u
Formula C19H31NO
InChI InChI=1S/C19H31NO/c1-6-12-20(15-17-10-8-7-9-11-17)18(21)13-16(2)14-19(3,4)5/h7-11,16H,6,12-15H2,1-5H3
InChIKey XZZKCBMLECGUMV-UHFFFAOYSA-N
Molecular Weight 289.463 g/mol
SMILES C(N(CCC)CC1=CC=CC=C1)(=O)CC(C)CC(C)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.928622