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Octadecanoic acid, 1-[(dodecyloxy)methyl]-1,2-ethanediyl ester
SpectraBase Compound ID IQP8a3G1Efo
InChI InChI=1S/C51H100O5/c1-4-7-10-13-16-19-22-24-26-28-30-32-35-38-41-44-50(52)55-48-49(47-54-46-43-40-37-34-21-18-15-12-9-6-3)56-51(53)45-42-39-36-33-31-29-27-25-23-20-17-14-11-8-5-2/h49H,4-48H2,1-3H3
InChIKey PTFPZKGPJIEOSX-UHFFFAOYSA-N
Mol Weight 793.4 g/mol
Molecular Formula C51H100O5
Exact Mass 792.757076 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 96EO0MClSUH
Name Octadecanoic acid, 1-[(dodecyloxy)methyl]-1,2-ethanediyl ester
CAS Registry Number 10322-32-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C51H100O5
InChI InChI=1S/C51H100O5/c1-4-7-10-13-16-19-22-24-26-28-30-32-35-38-41-44-50(52)55-48-49(47-54-46-43-40-37-34-21-18-15-12-9-6-3)56-51(53)45-42-39-36-33-31-29-27-25-23-20-17-14-11-8-5-2/h49H,4-48H2,1-3H3
InChIKey PTFPZKGPJIEOSX-UHFFFAOYSA-N
Molecular Weight 793.356 g/mol
SMILES C(OC(CCCCCCCCCCCCCCCCC)=O)(COC(CCCCCCCCCCCCCCCCC)=O)COCCCCCCCCCCCC
SPLASH splash10-0a4l-9241010000-8fd2b080f49d415eba43
Source of Spectrum EP-5214-0-0
Synonyms 2-(Dodecyloxy)-1-[(stearoyloxy)methyl]ethyl stearate (3-dodecoxy-2-octadecanoyloxy-propyl) octadecanoate 1-Dodecyl-2,3-distearoylglycerol stearic acid (3-lauryloxy-2-stearoyloxy-propyl) ester Stearic acid, [(dodecyloxy)methyl]ethylene ester Octadecanoic acid [3-dodecoxy-2-(1-oxooctadecoxy)propyl] ester
Wiley ID 1417059