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6-(1H-imidazol-1-yl)octadecanoic acid

View entire compound with spectra: 1 MS (GC)

6-(1H-imidazol-1-yl)octadecanoic acid
SpectraBase Compound ID LfchGcQtIKT
InChI InChI=1S/C21H38N2O2/c1-2-3-4-5-6-7-8-9-10-11-14-20(23-18-17-22-19-23)15-12-13-16-21(24)25/h17-20H,2-16H2,1H3,(H,24,25)
InChIKey VWPSUNAARYNSOO-UHFFFAOYSA-N
Mol Weight 350.5 g/mol
Molecular Formula C21H38N2O2
Exact Mass 350.293328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5gyZnjGLKmA
Name 6-(1H-imidazol-1-yl)octadecanoic acid
Appearance Gummy liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H38N2O2
InChI InChI=1S/C21H38N2O2/c1-2-3-4-5-6-7-8-9-10-11-14-20(23-18-17-22-19-23)15-12-13-16-21(24)25/h17-20H,2-16H2,1H3,(H,24,25)
InChIKey VWPSUNAARYNSOO-UHFFFAOYSA-N
Ionization Type EI positive ion
Molecular Weight 350.547 g/mol
SMILES OC(CCCCC(CCCCCCCCCCCC)[n]1cncc1)=O
SPLASH splash10-00kf-9000000000-ff998f47ee8efb7ad83f
Source of Spectrum US20130203829A1
Wiley ID 1847741