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 Google Search
Mol Weight	793.4 g/mol
Molecular Formula	C51H100O5
Exact Mass	792.757076 g/mol

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SpectraBase Spectrum ID	96EO0MClSUH
Name	Octadecanoic acid, 1-[(dodecyloxy)methyl]-1,2-ethanediyl ester
Alternate Name(s)	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
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
Wiley ID	1417059