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2,3-Dinicotinoyl-1-octadecanoyl-rac-glycerol
SpectraBase Compound ID ExFRZiXHDgF
InChI InChI=1S/C33H48N2O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-31(36)39-26-30(41-33(38)29-20-18-23-35-25-29)27-40-32(37)28-19-17-22-34-24-28/h17-20,22-25,30H,2-16,21,26-27H2,1H3
InChIKey BRKFYBDCZUCULL-UHFFFAOYSA-N
Mol Weight 568.8 g/mol
Molecular Formula C33H48N2O6
Exact Mass 568.351237 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7W3l5YIhVbu
Name 2,3-Dinicotinoyl-1-octadecanoyl-rac-glycerol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H48N2O6
InChI InChI=1S/C33H48N2O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-31(36)39-26-30(41-33(38)29-20-18-23-35-25-29)27-40-32(37)28-19-17-22-34-24-28/h17-20,22-25,30H,2-16,21,26-27H2,1H3
InChIKey BRKFYBDCZUCULL-UHFFFAOYSA-N
Molecular Weight 568.755 g/mol
SMILES C(c1cnccc1)(OC(COC(c1cnccc1)=O)COC(=O)CCCCCCCCCCCCCCCCC)=O
SPLASH splash10-0c00-0902000000-e0fa309bc11d40e1da2d
Source of Spectrum O-29-253-0
Synonyms 2-[(3-pyridinylcarbonyl)oxy]-1-[(stearoyloxy)methyl]ethyl nicotinate
Wiley ID 1407535