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Glutaric acid, monoamide, N-dodecyl-, butyl ester

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

Glutaric acid, monoamide, N-dodecyl-, butyl ester
SpectraBase Compound ID InJPKrJpwcm
InChI InChI=1S/C21H41NO3/c1-3-5-7-8-9-10-11-12-13-14-18-22-20(23)16-15-17-21(24)25-19-6-4-2/h3-19H2,1-2H3,(H,22,23)
InChIKey RJAKQPSCEJAAAN-UHFFFAOYSA-N
Mol Weight 355.6 g/mol
Molecular Formula C21H41NO3
Exact Mass 355.308644 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GyXYXSmE9NC
Name Glutaric acid, monoamide, N-dodecyl-, butyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 355.308644181 u
Formula C21H41NO3
InChI InChI=1S/C21H41NO3/c1-3-5-7-8-9-10-11-12-13-14-18-22-20(23)16-15-17-21(24)25-19-6-4-2/h3-19H2,1-2H3,(H,22,23)
InChIKey RJAKQPSCEJAAAN-UHFFFAOYSA-N
Molecular Weight 355.563 g/mol
SMILES CCCCOC(CCCC(NCCCCCCCCCCCC)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.928153