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2-Hydroxy-heptadecanoic acid, pyrrolidide

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

2-Hydroxy-heptadecanoic acid, pyrrolidide
SpectraBase Compound ID Hr5aaizuFSG
InChI InChI=1S/C21H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-20(23)21(24)22-18-15-16-19-22/h20,23H,2-19H2,1H3
InChIKey SHRBLSVRSSRRDN-UHFFFAOYSA-N
Mol Weight 339.6 g/mol
Molecular Formula C21H41NO2
Exact Mass 339.31373 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6exkDDBw370
Name 2-Hydroxy-heptadecanoic acid, pyrrolidide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 339.313729562 u
Formula C21H41NO2
InChI InChI=1S/C21H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-20(23)21(24)22-18-15-16-19-22/h20,23H,2-19H2,1H3
InChIKey SHRBLSVRSSRRDN-UHFFFAOYSA-N
Molecular Weight 339.564 g/mol
SMILES C(N1CCCC1)(C(CCCCCCCCCCCCCCC)O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.852229