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(3S,5S,7S,10R,11R,E)-5-((tert-Butyldimethylsilyl)oxy)-13-(dimethyl(phenyl)silyl)-3,7,10-trimethyltridec-12-en-8-yne-1,11-diol

View entire compound with spectra: 1 MS (GC)

(3S,5S,7S,10R,11R,E)-5-((tert-Butyldimethylsilyl)oxy)-13-(dimethyl(phenyl)silyl)-3,7,10-trimethyltridec-12-en-8-yne-1,11-diol
SpectraBase Compound ID 3XGqmSw5yQ9
InChI InChI=1S/C30H52O3Si2/c1-24(22-27(23-25(2)18-20-31)33-35(9,10)30(4,5)6)16-17-26(3)29(32)19-21-34(7,8)28-14-12-11-13-15-28/h11-15,19,21,24-27,29,31-32H,18,20,22-23H2,1-10H3/b21-19+/t24-,25+,26-,27-,29+/m1/s1
InChIKey LCGPFIRBOUWGRC-MWPPZIPTSA-N
Mol Weight 516.9 g/mol
Molecular Formula C30H52O3Si2
Exact Mass 516.345499 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F74z0UlX7YY
Name (3S,5S,7S,10R,11R,E)-5-((tert-Butyldimethylsilyl)oxy)-13-(dimethyl(phenyl)silyl)-3,7,10-trimethyltridec-12-en-8-yne-1,11-diol
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H52O3Si2
InChI InChI=1S/C30H52O3Si2/c1-24(22-27(23-25(2)18-20-31)33-35(9,10)30(4,5)6)16-17-26(3)29(32)19-21-34(7,8)28-14-12-11-13-15-28/h11-15,19,21,24-27,29,31-32H,18,20,22-23H2,1-10H3/b21-19+/t24-,25+,26-,27-,29+/m1/s1
InChIKey LCGPFIRBOUWGRC-MWPPZIPTSA-N
Instrument Name Finnigan MAT 8200
Ionization Type EI
Literature Reference DOI 10.1002/chem.201804987
Molecular Weight 516.913 g/mol
Optical Rotation [a]D20 = +59.8 (c = 0.5, CHCl3)
Reported Formula C30H52O3Si2
SMILES O[C@]([C@@](C#C[C@](C[C@](C[C@](CCO)(C)[H])(O[Si](C(C)(C)C)(C)C)[H])(C)[H])(C)[H])(\C=C\[Si](c1ccccc1)(C)C)[H]
SPLASH splash10-009j-5900000000-f254233ce2330c09dcf2
Source of Spectrum QE-25-SM19-S9
Wiley ID 1845993