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3.alpha.,4.alpha.-diacetoxy-1.beta.-((benzoyloxy)methyl)-1-(1-methyl-4-hydroxy-4-methylcyclohex-2-enyl)-2.beta.-(9tert-butyldi-methylsilyl)oxy)cyclopentane

View entire compound with spectra: 1 MS (GC)

3.alpha.,4.alpha.-diacetoxy-1.beta.-((benzoyloxy)methyl)-1-(1-methyl-4-hydroxy-4-methylcyclohex-2-enyl)-2.beta.-(9tert-butyldi-methylsilyl)oxy)cyclopentane
SpectraBase Compound ID DuznNA2wX7C
InChI InChI=1S/C31H48O7Si/c1-20-15-16-30(7,35)17-24(20)31(18-25(34)23-13-11-10-12-14-23)19-26(36-21(2)32)27(37-22(3)33)28(31)38-39(8,9)29(4,5)6/h10-14,20,24,26-28,35H,15-19H2,1-9H3/t20?,24?,26-,27-,28+,30?,31-/m1/s1
InChIKey UQDWZKAGNCUSCN-YRSJTNKXSA-N
Mol Weight 560.8 g/mol
Molecular Formula C31H48O7Si
Exact Mass 560.31693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2jv36oYET1V
Name 3.alpha.,4.alpha.-diacetoxy-1.beta.-((benzoyloxy)methyl)-1-(1-methyl-4-hydroxy-4-methylcyclohex-2-enyl)-2.beta.-(9tert-butyldi-methylsilyl)oxy)cyclopentane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H48O7Si
InChI InChI=1S/C31H48O7Si/c1-20-15-16-30(7,35)17-24(20)31(18-25(34)23-13-11-10-12-14-23)19-26(36-21(2)32)27(37-22(3)33)28(31)38-39(8,9)29(4,5)6/h10-14,20,24,26-28,35H,15-19H2,1-9H3/t20?,24?,26-,27-,28+,30?,31-/m1/s1
InChIKey UQDWZKAGNCUSCN-YRSJTNKXSA-N
Molecular Weight 560.803 g/mol
SMILES OC1(CC([C@@]2([C@]([C@](OC(=O)C)([C@@](C2)(OC(=O)C)[H])[H])(O[Si](C(C)(C)C)(C)C)[H])CC(=O)c2ccccc2)C(CC1)C)C
SPLASH splash10-0a4i-1900000000-e8a353778d7c232de1e5
Source of Spectrum J-51-1946-22
Synonyms (1R,2R,3R,4S)-2-(acetyloxy)-3-{[tert-butyl(dimethyl)silyl]oxy}-4-(5-hydroxy-2,5-dimethylcyclohexyl)-4-(2-oxo-2-phenylethyl)cyclopentyl acetate
Wiley ID 1406765