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Valeramide, 5-phenyl-N-3-methylbutyl-

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

Valeramide, 5-phenyl-N-3-methylbutyl-
SpectraBase Compound ID LWyTqDqivJ2
InChI InChI=1S/C16H25NO/c1-14(2)12-13-17-16(18)11-7-6-10-15-8-4-3-5-9-15/h3-5,8-9,14H,6-7,10-13H2,1-2H3,(H,17,18)
InChIKey YPZJJTKWLAFYCL-UHFFFAOYSA-N
Mol Weight 247.38 g/mol
Molecular Formula C16H25NO
Exact Mass 247.193614 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3tDKAiu77eE
Name Valeramide, 5-phenyl-N-3-methylbutyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 247.193614428 u
Formula C16H25NO
InChI InChI=1S/C16H25NO/c1-14(2)12-13-17-16(18)11-7-6-10-15-8-4-3-5-9-15/h3-5,8-9,14H,6-7,10-13H2,1-2H3,(H,17,18)
InChIKey YPZJJTKWLAFYCL-UHFFFAOYSA-N
Molecular Weight 247.382 g/mol
SMILES C(=O)(NCCC(C)C)CCCCC1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.973821