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2-(sec-Butylamino)-1-phenylbutan-1-one

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

2-(sec-Butylamino)-1-phenylbutan-1-one
SpectraBase Compound ID 2keveMVWVBy
InChI InChI=1S/C14H21NO/c1-4-11(3)15-13(5-2)14(16)12-9-7-6-8-10-12/h6-11,13,15H,4-5H2,1-3H3
InChIKey ISRJXKQVDUYYND-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 CMOVKYTovwE
Name 2-(sec-Butylamino)-1-phenylbutan-1-one
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/c1-4-11(3)15-13(5-2)14(16)12-9-7-6-8-10-12/h6-11,13,15H,4-5H2,1-3H3
InChIKey ISRJXKQVDUYYND-UHFFFAOYSA-N
Molecular Weight 219.328 g/mol
SMILES C(C(C1=CC=CC=C1)=O)(NC(CC)C)CC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.8922