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(2R,4E,5E,9E)-1-(t-butyldiphenylsiianyloxy)-2,6,10,14-tetramethyl-4-toluenesulfonylpentadeca-5,9,13-trien-2-ol
SpectraBase Compound ID 2wTlbpssMYB
InChI InChI=1S/C42H58O4SSi/c1-33(2)23-24-34(3)17-16-18-35(4)27-30-38(47(44,45)37-28-25-36(5)26-29-37)31-42(9,43)32-46-48(41(6,7)8,39-19-12-10-13-20-39)40-21-14-11-15-22-40/h10-17,19-23,25-30,34-35,38,43H,18,24,31-32H2,1-9H3/b17-16+,30-27+/t34?,35?,38?,42-/m1/s1
InChIKey OMUOFLZVYYMRPR-XZVKBROESA-N
Mol Weight 687.1 g/mol
Molecular Formula C42H58O4SSi
Exact Mass 686.382508 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5I52BRXTwnR
Name (2R,4E,5E,9E)-1-(t-butyldiphenylsiianyloxy)-2,6,10,14-tetramethyl-4-toluenesulfonylpentadeca-5,9,13-trien-2-ol
CAS Registry Number 123067-89-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C42H58O4SSi
InChI InChI=1S/C42H58O4SSi/c1-33(2)23-24-34(3)17-16-18-35(4)27-30-38(47(44,45)37-28-25-36(5)26-29-37)31-42(9,43)32-46-48(41(6,7)8,39-19-12-10-13-20-39)40-21-14-11-15-22-40/h10-17,19-23,25-30,34-35,38,43H,18,24,31-32H2,1-9H3/b17-16+,30-27+/t34?,35?,38?,42-/m1/s1
InChIKey OMUOFLZVYYMRPR-XZVKBROESA-N
Molecular Weight 687.067 g/mol
SMILES O[C@](CC(S(c1ccc(cc1)C)(=O)=O)\C=C\C(C\C=C\C(CC=C(C)C)C)C)(CO[Si](C(C)(C)C)(c1ccccc1)c1ccccc1)C
SPLASH splash10-052r-0090000000-aee6604e9432e69e5823
Source of Spectrum F-44-6332-24
Synonyms (2R,5E,9E)-1-{[tert-butyl(diphenyl)silyl]oxy}-2,7,11,14-tetramethyl-4-[(4-methylphenyl)sulfonyl]-5,9,13-pentadecatrien-2-ol
Wiley ID 1414561