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Valeramide, 5-phenyl-N-nonyl-

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Valeramide, 5-phenyl-N-nonyl-
SpectraBase Compound ID GEOYrhNiQXx
InChI InChI=1S/C20H33NO/c1-2-3-4-5-6-7-13-18-21-20(22)17-12-11-16-19-14-9-8-10-15-19/h8-10,14-15H,2-7,11-13,16-18H2,1H3,(H,21,22)
InChIKey KPYDKTVIENGLSI-UHFFFAOYSA-N
Mol Weight 303.5 g/mol
Molecular Formula C20H33NO
Exact Mass 303.256215 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5Fxw3dkNK3I
Name Valeramide, 5-phenyl-N-nonyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 303.256214686 u
Formula C20H33NO
InChI InChI=1S/C20H33NO/c1-2-3-4-5-6-7-13-18-21-20(22)17-12-11-16-19-14-9-8-10-15-19/h8-10,14-15H,2-7,11-13,16-18H2,1H3,(H,21,22)
InChIKey KPYDKTVIENGLSI-UHFFFAOYSA-N
SMILES C(=O)(NCCCCCCCCC)CCCCC1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.947956