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(3R,3aR,5S,7E,7aS)-7-[(2Z)-2-[(3S,5R)-3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylene-cyclohexylidene]ethylidene]-3-[(1R)-5-hydroxy-1,5-dimethyl-hexyl]-3a-methyl-2,3,4,5,6,7a-hexahydro-1H-inden-5-ol

View entire compound with spectra: 1 MS (GC)

(3R,3aR,5S,7E,7aS)-7-[(2Z)-2-[(3S,5R)-3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylene-cyclohexylidene]ethylidene]-3-[(1R)-5-hydroxy-1,5-dimethyl-hexyl]-3a-methyl-2,3,4,5,6,7a-hexahydro-1H-inden-5-ol
SpectraBase Compound ID EfghIkTIxoB
InChI InChI=1S/C39H72O4Si2/c1-27(17-16-22-38(9,10)41)33-20-21-34-30(23-31(40)26-39(33,34)11)19-18-29-24-32(42-44(12,13)36(3,4)5)25-35(28(29)2)43-45(14,15)37(6,7)8/h18-19,27,31-35,40-41H,2,16-17,20-26H2,1,3-15H3/b29-18-,30-19+/t27-,31+,32-,33-,34+,35+,39-/m1/s1
InChIKey RATQXHSDQOYSJX-AGAUCTRDSA-N
Mol Weight 661.2 g/mol
Molecular Formula C39H72O4Si2
Exact Mass 660.496914 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ErIJC7e9NZC
Name (3R,3aR,5S,7E,7aS)-7-[(2Z)-2-[(3S,5R)-3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylene-cyclohexylidene]ethylidene]-3-[(1R)-5-hydroxy-1,5-dimethyl-hexyl]-3a-methyl-2,3,4,5,6,7a-hexahydro-1H-inden-5-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C39H72O4Si2
InChI InChI=1S/C39H72O4Si2/c1-27(17-16-22-38(9,10)41)33-20-21-34-30(23-31(40)26-39(33,34)11)19-18-29-24-32(42-44(12,13)36(3,4)5)25-35(28(29)2)43-45(14,15)37(6,7)8/h18-19,27,31-35,40-41H,2,16-17,20-26H2,1,3-15H3/b29-18-,30-19+/t27-,31+,32-,33-,34+,35+,39-/m1/s1
InChIKey RATQXHSDQOYSJX-AGAUCTRDSA-N
Molecular Weight 661.171 g/mol
SMILES O[C@]1(C\C([C@]2([C@@]([C@@]([C@@](CCCC(O)(C)C)(C)[H])(CC2)[H])(C1)C)[H])=C\C=C/1C([C@@](O[Si](C(C)(C)C)(C)C)(C[C@@](C1)(O[Si](C(C)(C)C)(C)C)[H])[H])=C)[H]
SPLASH splash10-0002-0090011000-71ee4eb903ec95cc8c46
Source of Spectrum KC-0-1814-19
Synonyms (3R,3aR,5S,7E,7aS)-7-[(2Z)-2-[(3S,5R)-3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylenecyclohexylidene]ethylidene]-3-[(2R)-6-hydroxy-6-methylheptan-2-yl]-3a-methyl-2,3,4,5,6,7a-hexahydro-1H-inden-5-ol (3R,3aR,5S,7E,7aS)-7-[(2Z)-2-[(3S,5R)-3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylidene-cyclohexylidene]ethylidene]-3a-methyl-3-[(2R)-6-methyl-6-oxidanyl-heptan-2-yl]-2,3,4,5,6,7a-hexahydro-1H-inden-5-ol (3R,3aR,5S,7E,7aS)-7-[(2Z)-2-[(3S,5R)-3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylidenecyclohexylidene]ethylidene]-3-[(2R)-6-hydroxy-6-methylheptan-2-yl]-3a-methyl-2,3,4,5,6,7a-hexahydro-1H-inden-5-ol
Wiley ID 781582