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N-isobutyl-2-methyl-3-phenyl-propanamide

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

N-isobutyl-2-methyl-3-phenyl-propanamide
SpectraBase Compound ID 6rdBlixZycW
InChI InChI=1S/C14H21NO/c1-11(2)10-15-14(16)12(3)9-13-7-5-4-6-8-13/h4-8,11-12H,9-10H2,1-3H3,(H,15,16)
InChIKey VAXRKXYDEMJWHS-UHFFFAOYSA-N
Mol Weight 219.33 g/mol
Molecular Formula C14H21NO
Exact Mass 219.162314 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8LkZeK0rZxy
Name N-Isobutyl-2-methyl-3-phenylpropanamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 219.162314299 u
Formula C14H21NO
InChI InChI=1S/C14H21NO/c1-11(2)10-15-14(16)12(3)9-13-7-5-4-6-8-13/h4-8,11-12H,9-10H2,1-3H3,(H,15,16)
InChIKey VAXRKXYDEMJWHS-UHFFFAOYSA-N
Molecular Weight 219.328 g/mol
SMILES C(NCC(C)C)(C(CC=1C=CC=CC1)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.862507