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N-(4',13'-Dimethyltetradecanoyl)pyrrolidine

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

N-(4',13'-Dimethyltetradecanoyl)pyrrolidine
SpectraBase Compound ID GOr9XQv2o0w
InChI InChI=1S/C20H39NO/c1-18(2)12-8-6-4-5-7-9-13-19(3)14-15-20(22)21-16-10-11-17-21/h18-19H,4-17H2,1-3H3
InChIKey XLXQWQGSAVEPHE-UHFFFAOYSA-N
Mol Weight 309.5 g/mol
Molecular Formula C20H39NO
Exact Mass 309.303165 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DCvnb200doR
Name N-(4',13'-Dimethyltetradecanoyl)pyrrolidine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 309.303164879 u
Formula C20H39NO
InChI InChI=1S/C20H39NO/c1-18(2)12-8-6-4-5-7-9-13-19(3)14-15-20(22)21-16-10-11-17-21/h18-19H,4-17H2,1-3H3
InChIKey XLXQWQGSAVEPHE-UHFFFAOYSA-N
Molecular Weight 309.538 g/mol
SMILES C(N1CCCC1)(=O)CCC(CCCCCCCCC(C)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.945015