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Methyl 11(S)-[(tert-butyldiphenylsilyl)oxy]-5-(Z),8(Z),12(E),14(Z)-eicosatetraenoate
SpectraBase Compound ID 3TxMSfdwLd0
InChI InChI=1S/C37H52O3Si/c1-6-7-8-9-11-14-19-26-33(27-20-15-12-10-13-16-25-32-36(38)39-5)40-41(37(2,3)4,34-28-21-17-22-29-34)35-30-23-18-24-31-35/h10-11,13-15,17-24,26,28-31,33H,6-9,12,16,25,27,32H2,1-5H3/b13-10-,14-11-,20-15-,26-19+/t33-/m1/s1
InChIKey DWMDNBRGLORORY-HXDQYAATSA-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 9rR8EaxDJE5
Name Methyl 11(S)-[(tert-butyldiphenylsilyl)oxy]-5-(Z),8(Z),12(E),14(Z)-eicosatetraenoate
Alternate Name(s) Methyl (5Z,8Z,11S,12E,14Z)-11-{[tert-butyl(diphenyl)silyl]oxy}-5,8,12,14-icosatetraenoate
CAS Registry Number 105457-25-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C37H52O3Si
InChI InChI=1S/C37H52O3Si/c1-6-7-8-9-11-14-19-26-33(27-20-15-12-10-13-16-25-32-36(38)39-5)40-41(37(2,3)4,34-28-21-17-22-29-34)35-30-23-18-24-31-35/h10-11,13-15,17-24,26,28-31,33H,6-9,12,16,25,27,32H2,1-5H3/b13-10-,14-11-,20-15-,26-19+/t33-/m1/s1
InChIKey DWMDNBRGLORORY-HXDQYAATSA-N
Molecular Weight 572.905 g/mol
SMILES C([Si](O[C@](\C=C\C=C/CCCCC)(C\C=C/C\C=C/CCCC(=O)OC)[H])(c1ccccc1)c1ccccc1)(C)(C)C
SPLASH splash10-0006-0009010000-74e0176c53ff0a7cc4ae
Source of Spectrum J-51-4800-12
Wiley ID 1407914