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Capryloylamide, N-(2-phenylethyl)-N-(3-methylbutyl)-

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

Capryloylamide, N-(2-phenylethyl)-N-(3-methylbutyl)-
SpectraBase Compound ID J9Dsi9SfAv9
InChI InChI=1S/C21H35NO/c1-4-5-6-7-11-14-21(23)22(17-15-19(2)3)18-16-20-12-9-8-10-13-20/h8-10,12-13,19H,4-7,11,14-18H2,1-3H3
InChIKey WAANRJBZHLSSNX-UHFFFAOYSA-N
Mol Weight 317.5 g/mol
Molecular Formula C21H35NO
Exact Mass 317.271865 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BXdg8f0iq9W
Name Capryloylamide, N-(2-phenylethyl)-N-(3-methylbutyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 317.271864750 u
Formula C21H35NO
InChI InChI=1S/C21H35NO/c1-4-5-6-7-11-14-21(23)22(17-15-19(2)3)18-16-20-12-9-8-10-13-20/h8-10,12-13,19H,4-7,11,14-18H2,1-3H3
InChIKey WAANRJBZHLSSNX-UHFFFAOYSA-N
Molecular Weight 317.517 g/mol
SMILES C1=CC=CC(=C1)CCN(C(=O)CCCCCCC)CCC(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.934464