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(1R,5S,6R)-1-[(E)-5'-(t-Butyldimethylsilyloxy)-3'-methyl-3'-pentenyl]-5-[(2''E,6''Z)-7''-(t-butyldimethylsilyloxy)methyl-3'',11''-dimethyl-2'',6'',10''-dodecatrienyl]-6-methylbicyclo[4.1.0]heptan-2-one

View entire compound with spectra: 1 MS (GC)

(1R,5S,6R)-1-[(E)-5'-(t-Butyldimethylsilyloxy)-3'-methyl-3'-pentenyl]-5-[(2''E,6''Z)-7''-(t-butyldimethylsilyloxy)methyl-3'',11''-dimethyl-2'',6'',10''-dodecatrienyl]-6-methylbicyclo[4.1.0]heptan-2-one
SpectraBase Compound ID 5VaZqZWUx5A
InChI InChI=1S/C41H74O3Si2/c1-32(2)18-16-20-35(30-44-46(14,15)39(8,9)10)21-17-19-33(3)22-23-36-24-25-37(42)41(31-40(36,41)11)28-26-34(4)27-29-43-45(12,13)38(5,6)7/h18,21-22,27,36H,16-17,19-20,23-26,28-31H2,1-15H3/b33-22+,34-27+,35-21-/t36-,40-,41+/m1/s1
InChIKey VIPGVNLBYRVSNX-BNWSIUCISA-N
Mol Weight 671.2 g/mol
Molecular Formula C41H74O3Si2
Exact Mass 670.517649 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KYQT7SnVIOy
Name (1R,5S,6R)-1-[(E)-5'-(t-Butyldimethylsilyloxy)-3'-methyl-3'-pentenyl]-5-[(2''E,6''Z)-7''-(t-butyldimethylsilyloxy)methyl-3'',11''-dimethyl-2'',6'',10''-dodecatrienyl]-6-methylbicyclo[4.1.0]heptan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C41H74O3Si2
InChI InChI=1S/C41H74O3Si2/c1-32(2)18-16-20-35(30-44-46(14,15)39(8,9)10)21-17-19-33(3)22-23-36-24-25-37(42)41(31-40(36,41)11)28-26-34(4)27-29-43-45(12,13)38(5,6)7/h18,21-22,27,36H,16-17,19-20,23-26,28-31H2,1-15H3/b33-22+,34-27+,35-21-/t36-,40-,41+/m1/s1
InChIKey VIPGVNLBYRVSNX-BNWSIUCISA-N
Molecular Weight 671.210 g/mol
SMILES [C@@]12([C@]([C@](C\C=C\(CC\C=C/(CO[Si](C(C)(C)C)(C)C)CCC=C(C)C)C)(CCC2=O)[H])(C)C1)CC\C(=C\CO[Si](C(C)(C)C)(C)C)C
SPLASH splash10-004i-9320000000-14e68449e9493ab40cba
Source of Spectrum F5-2-2243-26
Synonyms (1R,5S,6R)-1-((E)-5-((tert-butyldimethylsilyl)oxy)-3-methylpent-3-en-1-yl)-5-((2E,6Z)-7-(((tert-butyldimethylsilyl)oxy)methyl)-3,11-dimethyldodeca-2,6,10-trien-1-yl)-6-methylbicyclo[4.1.0]heptan-2-one (1R,2S,6R)-2-[(2E,6Z)-7-[[tert-butyl(dimethyl)silyl]oxymethyl]-3,11-dimethyldodeca-2,6,10-trienyl]-6-[(E)-5-[tert-butyl(dimethyl)silyl]oxy-3-methylpent-3-enyl]-1-methyl-5-bicyclo[4.1.0]heptanone (1R,2S,6R)-2-[(2E,6Z)-7-[[tert-butyl(dimethyl)silyl]oxymethyl]-3,11-dimethyldodeca-2,6,10-trienyl]-6-[(E)-5-[tert-butyl(dimethyl)silyl]oxy-3-methylpent-3-enyl]-1-methylbicyclo[4.1.0]heptan-5-one (1R,2S,6R)-2-[(2E,6Z)-7-[[tert-butyl(dimethyl)silyl]oxymethyl]-3,11-dimethyl-dodeca-2,6,10-trienyl]-6-[(E)-5-[tert-butyl(dimethyl)silyl]oxy-3-methyl-pent-3-enyl]-1-methyl-bicyclo[4.1.0]heptan-5-one
Wiley ID 1731956