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(1S,4S,5S)-4-(3-((tert-Butyldiphenylsilyl)oxy)-1-(methoxycarbony)-2-oxopropyl)-1-methyl-6-methylenebicyclo[3.3.0]oct-2-ene
SpectraBase Compound ID EKx7vKvOKft
InChI InChI=1S/C31H38O4Si/c1-22-17-19-31(5)20-18-25(28(22)31)27(29(33)34-6)26(32)21-35-36(30(2,3)4,23-13-9-7-10-14-23)24-15-11-8-12-16-24/h7-16,18,20,25,27-28H,1,17,19,21H2,2-6H3/t25-,27?,28-,31+/m1/s1
InChIKey JNJJZNJMWXQWLR-YTXDOLHBSA-N
Mol Weight 502.7 g/mol
Molecular Formula C31H38O4Si
Exact Mass 502.253936 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 334vkwUjZHe
Name (1S,4S,5S)-4-(3-((tert-Butyldiphenylsilyl)oxy)-1-(methoxycarbony)-2-oxopropyl)-1-methyl-6-methylenebicyclo[3.3.0]oct-2-ene
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Formula C31H38O4Si
InChI InChI=1S/C31H38O4Si/c1-22-17-19-31(5)20-18-25(28(22)31)27(29(33)34-6)26(32)21-35-36(30(2,3)4,23-13-9-7-10-14-23)24-15-11-8-12-16-24/h7-16,18,20,25,27-28H,1,17,19,21H2,2-6H3/t25-,27?,28-,31+/m1/s1
InChIKey JNJJZNJMWXQWLR-YTXDOLHBSA-N
Molecular Weight 502.726 g/mol
SMILES [C@]1(C(C(=O)OC)C(CO[Si](C(C)(C)C)(c2ccccc2)c2ccccc2)=O)([C@@]2([C@](CCC2=C)(C)C=C1)[H])[H]
SPLASH splash10-001i-0901000000-2c7b530221d861e91881
Source of Spectrum C-118-7114-6
Synonyms Methyl (2S)-2-[(1S,3aS,6aS)-3a-methyl-6-methylene-1,3a,4,5,6,6a-hexahydro-1-pentalenyl]-4-{[tert-butyl(diphenyl)silyl]oxy}-3-oxobutanoate
Wiley ID 759906