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N-Normal-octadecyl-(4-methoxyphenyl)-acetamide

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

N-Normal-octadecyl-(4-methoxyphenyl)-acetamide
SpectraBase Compound ID BBbJVh62HKK
InChI InChI=1S/C27H47NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-28-27(29)24-25-19-21-26(30-2)22-20-25/h19-22H,3-18,23-24H2,1-2H3,(H,28,29)
InChIKey PKRUHTFNWIMXKK-UHFFFAOYSA-N
Mol Weight 417.7 g/mol
Molecular Formula C27H47NO2
Exact Mass 417.36068 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID xHXXL7tJRy
Name N-Normal-octadecyl-(4-methoxyphenyl)-acetamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 417.360679755 u
Formula C27H47NO2
InChI InChI=1S/C27H47NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-28-27(29)24-25-19-21-26(30-2)22-20-25/h19-22H,3-18,23-24H2,1-2H3,(H,28,29)
InChIKey PKRUHTFNWIMXKK-UHFFFAOYSA-N
Molecular Weight 417.678 g/mol
SMILES C(=O)(CC1=CC=C(OC)C=C1)NCCCCCCCCCCCCCCCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.843559