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

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

3-Cyclopentylpropionamide, N-(2-phenylethyl)-N-butyl-
SpectraBase Compound ID KtdSVbojY3y
InChI InChI=1S/C20H31NO/c1-2-3-16-21(17-15-19-9-5-4-6-10-19)20(22)14-13-18-11-7-8-12-18/h4-6,9-10,18H,2-3,7-8,11-17H2,1H3
InChIKey XZOUBVUHXJVJDM-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 9huw0dz5K1A
Name 3-Cyclopentylpropionamide, N-(2-phenylethyl)-N-butyl-
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/c1-2-3-16-21(17-15-19-9-5-4-6-10-19)20(22)14-13-18-11-7-8-12-18/h4-6,9-10,18H,2-3,7-8,11-17H2,1H3
InChIKey XZOUBVUHXJVJDM-UHFFFAOYSA-N
SMILES C1=CC=CC(=C1)CCN(C(=O)CCC1CCCC1)CCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.88787