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Pyrrolidine, 1-(1-oxo-6-octadecenyl)-

View entire compound with spectra: 1 NMR, 1 FTIR, and 2 MS (GC)

Pyrrolidine, 1-(1-oxo-6-octadecenyl)-
SpectraBase Compound ID DGLbsDlVvp0
InChI InChI=1S/C22H41NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22(24)23-20-17-18-21-23/h12-13H,2-11,14-21H2,1H3/b13-12+
InChIKey CQURANYXRGKAFK-OUKQBFOZSA-N
Mol Weight 335.6 g/mol
Molecular Formula C22H41NO
Exact Mass 335.318815 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CDEbtAGWJJb
Name Pyrrolidine, 1-(1-oxo-6-octadecenyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 335.318814943 u
Formula C22H41NO
InChI InChI=1S/C22H41NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22(24)23-20-17-18-21-23/h12-13H,2-11,14-21H2,1H3/b13-12+
InChIKey CQURANYXRGKAFK-OUKQBFOZSA-N
Molecular Weight 335.576 g/mol
SMILES C(C(=O)N1CCCC1)CCC\C=C\CCCCCCCCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.861928