For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

18-Methyl-eicosanoic acid, pyrrolidide

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

18-Methyl-eicosanoic acid, pyrrolidide
SpectraBase Compound ID GhibsTLLKIW
InChI InChI=1S/C25H49NO/c1-3-24(2)20-16-14-12-10-8-6-4-5-7-9-11-13-15-17-21-25(27)26-22-18-19-23-26/h24H,3-23H2,1-2H3
InChIKey ZISPNDGXXGACRS-UHFFFAOYSA-N
Mol Weight 379.7 g/mol
Molecular Formula C25H49NO
Exact Mass 379.381415 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Dnd9LJR7bNI
Name 18-Methyl-eicosanoic acid, pyrrolidide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 379.381415201 u
Formula C25H49NO
InChI InChI=1S/C25H49NO/c1-3-24(2)20-16-14-12-10-8-6-4-5-7-9-11-13-15-17-21-25(27)26-22-18-19-23-26/h24H,3-23H2,1-2H3
InChIKey ZISPNDGXXGACRS-UHFFFAOYSA-N
Molecular Weight 379.673 g/mol
SMILES C1N(CCC1)C(CCCCCCCCCCCCCCCCC(CC)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.88605