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1(4H)-Naphthalenone, 8-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-4a,5,6,7,8,8a-hexahydro-5,5,8a-trimethyl-3-(phenylthio)-, (4a.alpha.,8.beta.,8a.alpha.)-
SpectraBase Compound ID G2u7x7oFzu4
InChI InChI=1S/C25H38O2SSi/c1-23(2,3)29(7,8)27-22-14-15-24(4,5)20-16-19(17-21(26)25(20,22)6)28-18-12-10-9-11-13-18/h9-13,17,20,22H,14-16H2,1-8H3/t20-,22+,25+/m0/s1
InChIKey PADQAWQETRBMAF-NIRIFSCTSA-N
Mol Weight 430.7 g/mol
Molecular Formula C25H38O2SSi
Exact Mass 430.236178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2vcMxTpPH8f
Name 1(4H)-Naphthalenone, 8-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-4a,5,6,7,8,8a-hexahydro-5,5,8a-trimethyl-3-(phenylthio)-, (4a.alpha.,8.beta.,8a.alpha.)-
CAS Registry Number 130385-46-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H38O2SSi
InChI InChI=1S/C25H38O2SSi/c1-23(2,3)29(7,8)27-22-14-15-24(4,5)20-16-19(17-21(26)25(20,22)6)28-18-12-10-9-11-13-18/h9-13,17,20,22H,14-16H2,1-8H3/t20-,22+,25+/m0/s1
InChIKey PADQAWQETRBMAF-NIRIFSCTSA-N
Molecular Weight 430.722 g/mol
SMILES [C@]12(C(C=C(C[C@]2(C(C)(C)CC[C@]1(O[Si](C(C)(C)C)(C)C)[H])[H])Sc1ccccc1)=O)C
SPLASH splash10-00fr-9057000000-9587043aece40cd2b050
Source of Spectrum I-68-1176-28
Synonyms (4aS,8R,8aS)-8-{[tert-butyl(dimethyl)silyl]oxy}-5,5,8a-trimethyl-3-(phenylsulfanyl)-4a,5,6,7,8,8a-hexahydro-1(4H)-naphthalenone cis-3-phenylthio-5,6,4a,8a,7,8-hexahydro-5,5,8a-trimethyl-(4H)-naphthalen-8.alpha.(tert-butyldimethylsiloxy)-1-one
Wiley ID 1381624