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3-Cyclopentylpropionamide, N-(2-phenylethyl)-N-isobutyl-

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

3-Cyclopentylpropionamide, N-(2-phenylethyl)-N-isobutyl-
SpectraBase Compound ID KGWmhY9CMY3
InChI InChI=1S/C20H31NO/c1-17(2)16-21(15-14-19-8-4-3-5-9-19)20(22)13-12-18-10-6-7-11-18/h3-5,8-9,17-18H,6-7,10-16H2,1-2H3
InChIKey IZVYLZJXBQVCMJ-UHFFFAOYSA-N
Mol Weight 301.47 g/mol
Molecular Formula C20H31NO
Exact Mass 301.240565 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID gaLaOB62IL
Name 3-Cyclopentylpropionamide, N-(2-phenylethyl)-N-isobutyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 301.240564621 u
Formula C20H31NO
InChI InChI=1S/C20H31NO/c1-17(2)16-21(15-14-19-8-4-3-5-9-19)20(22)13-12-18-10-6-7-11-18/h3-5,8-9,17-18H,6-7,10-16H2,1-2H3
InChIKey IZVYLZJXBQVCMJ-UHFFFAOYSA-N
SMILES C1=CC=CC(=C1)CCN(C(=O)CCC1CCCC1)CC(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.876411