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Valeramide, 5-phenyl-N-pentyl-

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

Valeramide, 5-phenyl-N-pentyl-
SpectraBase Compound ID 8tz1jMbI0YX
InChI InChI=1S/C16H25NO/c1-2-3-9-14-17-16(18)13-8-7-12-15-10-5-4-6-11-15/h4-6,10-11H,2-3,7-9,12-14H2,1H3,(H,17,18)
InChIKey RXSDOJDLXBCWCN-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 5YDmnHoo4S6
Name Valeramide, 5-phenyl-N-pentyl-
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/c1-2-3-9-14-17-16(18)13-8-7-12-15-10-5-4-6-11-15/h4-6,10-11H,2-3,7-9,12-14H2,1H3,(H,17,18)
InChIKey RXSDOJDLXBCWCN-UHFFFAOYSA-N
Molecular Weight 247.382 g/mol
SMILES C(=O)(NCCCCC)CCCCC1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.976277