Glycerol 1,3-dihexandecanoate-2-(.delta.-9, 12)-octadecadienoate

SpectraBase Compound ID	23WFKRV8Gbv
InChI	InChI=1S/C53H98O6/c1-4-7-10-13-16-19-22-25-26-29-32-35-38-41-44-47-53(56)59-50(48-57-51(54)45-42-39-36-33-30-27-23-20-17-14-11-8-5-2)49-58-52(55)46-43-40-37-34-31-28-24-21-18-15-12-9-6-3/h16,19,25-26,50H,4-15,17-18,20-24,27-49H2,1-3H3/b19-16+,26-25+
InChIKey	HTGAUBMLVQRATC-GUKKWNCZSA-N Google Search
Mol Weight	831.4 g/mol
Molecular Formula	C53H98O6
Exact Mass	830.736341 g/mol

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SpectraBase Spectrum ID	3lnCnY8kwpP
Name	Glycerol 1,3-dihexandecanoate-2-(.delta.-9, 12)-octadecadienoate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C53H98O6
InChI	InChI=1S/C53H98O6/c1-4-7-10-13-16-19-22-25-26-29-32-35-38-41-44-47-53(56)59-50(48-57-51(54)45-42-39-36-33-30-27-23-20-17-14-11-8-5-2)49-58-52(55)46-43-40-37-34-31-28-24-21-18-15-12-9-6-3/h16,19,25-26,50H,4-15,17-18,20-24,27-49H2,1-3H3/b19-16+,26-25+
InChIKey	HTGAUBMLVQRATC-GUKKWNCZSA-N
Molecular Weight	831.361 g/mol
SMILES	C(OC(COC(=O)CCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCC)(=O)CCCCCCC\C=C\C\C=C\CCCCC
SPLASH	splash10-05gs-9300000000-185c5cbe8eab59f330b5
Source of Spectrum	PS-1999-0-116
Wiley ID	1417532