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(5Z,8Z,10E,12S,14Z)-12-[tert-butyl(diphenyl)silyl]oxyeicosa-5,8,10,14-tetraenoic acid methyl ester
SpectraBase Compound ID 27vGoBLsDpC
InChI InChI=1S/C37H52O3Si/c1-6-7-8-9-14-19-26-33(27-20-15-12-10-11-13-16-25-32-36(38)39-5)40-41(37(2,3)4,34-28-21-17-22-29-34)35-30-23-18-24-31-35/h11-15,17-24,27-31,33H,6-10,16,25-26,32H2,1-5H3/b13-11-,15-12-,19-14-,27-20+/t33-/m0/s1
InChIKey CLMHIYQKRUIVRC-LPHQVOJYSA-N
Mol Weight 572.9 g/mol
Molecular Formula C37H52O3Si
Exact Mass 572.368572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EEAfMPaVSBr
Name (5Z,8Z,10E,12S,14Z)-12-[tert-butyl(diphenyl)silyl]oxyeicosa-5,8,10,14-tetraenoic acid methyl ester
Alternate Name(s) Methyl (5Z,8Z,10E,12S,14Z)-12-[tert-butyl(diphenyl)silyl]oxyicosa-5,8,10,14-tetraenoate
CAS Registry Number 100428-43-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C37H52O3Si
InChI InChI=1S/C37H52O3Si/c1-6-7-8-9-14-19-26-33(27-20-15-12-10-11-13-16-25-32-36(38)39-5)40-41(37(2,3)4,34-28-21-17-22-29-34)35-30-23-18-24-31-35/h11-15,17-24,27-31,33H,6-10,16,25-26,32H2,1-5H3/b13-11-,15-12-,19-14-,27-20+/t33-/m0/s1
InChIKey CLMHIYQKRUIVRC-LPHQVOJYSA-N
Molecular Weight 572.905 g/mol
SMILES C([Si](O[C@](\C=C\C=C/C\C=C/CCCC(=O)OC)(C\C=C/CCCCC)[H])(c1ccccc1)c1ccccc1)(C)(C)C
SPLASH splash10-03di-0000900000-3ca9618a4f5379134926
Source of Spectrum J-51-4800-14
Wiley ID 1407915