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Carbonic acid, monoamide, N-(2-pentyl)-N-nonyl-, benzyl ester

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

Carbonic acid, monoamide, N-(2-pentyl)-N-nonyl-, benzyl ester
SpectraBase Compound ID H5sybbIco7H
InChI InChI=1S/C22H37NO2/c1-4-6-7-8-9-10-14-18-23(20(3)15-5-2)22(24)25-19-21-16-12-11-13-17-21/h11-13,16-17,20H,4-10,14-15,18-19H2,1-3H3
InChIKey RWIPNIDDSMLJSP-UHFFFAOYSA-N
Mol Weight 347.5 g/mol
Molecular Formula C22H37NO2
Exact Mass 347.282429 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5Bc9DwhZcl7
Name Carbonic acid, monoamide, N-(2-pentyl)-N-nonyl-, benzyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 347.282429433 u
Formula C22H37NO2
InChI InChI=1S/C22H37NO2/c1-4-6-7-8-9-10-14-18-23(20(3)15-5-2)22(24)25-19-21-16-12-11-13-17-21/h11-13,16-17,20H,4-10,14-15,18-19H2,1-3H3
InChIKey RWIPNIDDSMLJSP-UHFFFAOYSA-N
Molecular Weight 347.543 g/mol
SMILES CCCC(C)N(C(OCC=1C=CC=CC1)=O)CCCCCCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.857885