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Glutaric acid, monoamide, N-(2-phenylpropyl)-, undecyl ester

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

Glutaric acid, monoamide, N-(2-phenylpropyl)-, undecyl ester
SpectraBase Compound ID Ii22A9GweOE
InChI InChI=1S/C25H41NO3/c1-3-4-5-6-7-8-9-10-14-20-29-25(28)19-15-18-24(27)26-21-22(2)23-16-12-11-13-17-23/h11-13,16-17,22H,3-10,14-15,18-21H2,1-2H3,(H,26,27)
InChIKey XWPDRGGRQICRAE-UHFFFAOYSA-N
Mol Weight 403.6 g/mol
Molecular Formula C25H41NO3
Exact Mass 403.308644 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LSdUXn5r6BW
Name Glutaric acid, monoamide, N-(2-phenylpropyl)-, undecyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 403.308644181 u
Formula C25H41NO3
InChI InChI=1S/C25H41NO3/c1-3-4-5-6-7-8-9-10-14-20-29-25(28)19-15-18-24(27)26-21-22(2)23-16-12-11-13-17-23/h11-13,16-17,22H,3-10,14-15,18-21H2,1-2H3,(H,26,27)
InChIKey XWPDRGGRQICRAE-UHFFFAOYSA-N
Molecular Weight 403.607 g/mol
SMILES CCCCCCCCCCCOC(CCCC(NCC(C)C1=CC=CC=C1)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.829828