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(2R,5E,9E)-1-(t-butyldiphenylsilanyloxy)-2,6,10,14-tetramethyl-4-toluenesulfonylpentadeca-5,9,13-trien-2-ol
SpectraBase Compound ID CmHBC078rKw
InChI InChI=1S/C42H58O4SSi/c1-33(2)18-16-19-34(3)20-17-21-36(5)30-38(47(44,45)37-28-26-35(4)27-29-37)31-42(9,43)32-46-48(41(6,7)8,39-22-12-10-13-23-39)40-24-14-11-15-25-40/h10-15,18,20,22-30,38,43H,16-17,19,21,31-32H2,1-9H3/b34-20+,36-30+/t38?,42-/m1/s1
InChIKey JVKSROLVWLJLFA-YHOYARNKSA-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 EmHwMqWfcEB
Name (2R,5E,9E)-1-(t-butyldiphenylsilanyloxy)-2,6,10,14-tetramethyl-4-toluenesulfonylpentadeca-5,9,13-trien-2-ol
CAS Registry Number 123067-98-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C42H58O4SSi
InChI InChI=1S/C42H58O4SSi/c1-33(2)18-16-19-34(3)20-17-21-36(5)30-38(47(44,45)37-28-26-35(4)27-29-37)31-42(9,43)32-46-48(41(6,7)8,39-22-12-10-13-23-39)40-24-14-11-15-25-40/h10-15,18,20,22-30,38,43H,16-17,19,21,31-32H2,1-9H3/b34-20+,36-30+/t38?,42-/m1/s1
InChIKey JVKSROLVWLJLFA-YHOYARNKSA-N
Molecular Weight 687.067 g/mol
SMILES O[C@](CC(S(c1ccc(cc1)C)(=O)=O)\C=C\(CC\C=C\(CCC=C(C)C)C)C)(CO[Si](C(C)(C)C)(c1ccccc1)c1ccccc1)C
SPLASH splash10-052s-0490000000-fe1445be21a06a5f9597
Source of Spectrum F-44-6332-24
Wiley ID 1414562