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(E)-2-((3aS,4S,5R,6aS)-5-((tert-Butyldimethylsilyl)oxy-4-(tert-butyldimethylsilyl)oxy)methyl)hexahydropentalen-2(1H)-ylidene)ethanol
SpectraBase Compound ID BIXBh01wrWk
InChI InChI=1S/C23H46O3Si2/c1-22(2,3)27(7,8)25-16-20-19-14-17(11-12-24)13-18(19)15-21(20)26-28(9,10)23(4,5)6/h11,18-21,24H,12-16H2,1-10H3/b17-11+/t18-,19-,20+,21+/m0/s1
InChIKey JCDIPANNSMSBNI-YULIVZIRSA-N
Mol Weight 426.8 g/mol
Molecular Formula C23H46O3Si2
Exact Mass 426.298548 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GwPKQGOuCyK
Name (E)-2-((3aS,4S,5R,6aS)-5-((tert-Butyldimethylsilyl)oxy-4-(tert-butyldimethylsilyl)oxy)methyl)hexahydropentalen-2(1H)-ylidene)ethanol
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 426.298548408 u
Formula C23H46O3Si2
InChI InChI=1S/C23H46O3Si2/c1-22(2,3)27(7,8)25-16-20-19-14-17(11-12-24)13-18(19)15-21(20)26-28(9,10)23(4,5)6/h11,18-21,24H,12-16H2,1-10H3/b17-11+/t18-,19-,20+,21+/m0/s1
InChIKey JCDIPANNSMSBNI-YULIVZIRSA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/chem.201901163
Molecular Weight 426.788 g/mol
Optical Rotation [a]20 = -14.8 (365nm) (c = 0.42, n-hexane)
Quality 49
SMILES OC\C=C\1C[C@@]2([C@]([C@](O[Si](C)(C)C(C)(C)C)(C[C@@]2(C1)[H])[H])(CO[Si](C)(C)C(C)(C)C)[H])[H]
SPLASH splash10-0002-1900000000-dcd1607da6a4befd20e2
Sample Comments dr >/= 99:1
Source of Spectrum QE-25-SM8-(E)-3e (DOI: 10.1002/chem.201901163)
Wiley ID 1893723