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(+-)-(2.alpha.,4.alpha.,4a.alpha.)-[1,2,3,4,4a,5,6,7-Octahydro-.alpha.,.alpha.,1,4a-tetramethyl-4-[(methylsulfonyl)oxy]-2-naphthalenyl]methyl Acetate

View entire compound with spectra: 1 MS (GC)

(+-)-(2.alpha.,4.alpha.,4a.alpha.)-[1,2,3,4,4a,5,6,7-Octahydro-.alpha.,.alpha.,1,4a-tetramethyl-4-[(methylsulfonyl)oxy]-2-naphthalenyl]methyl Acetate
SpectraBase Compound ID 4GEKlJwy1eg
InChI InChI=1S/C18H30O5S/c1-12-8-7-9-18(4)14(12)10-13(17(2,3)16(19)22-5)11-15(18)23-24(6,20)21/h13,15H,7-11H2,1-6H3/t13-,15-,18-/m0/s1
InChIKey MDQUQYHJBIZKEX-YEWWUXTCSA-N
Mol Weight 358.49 g/mol
Molecular Formula C18H30O5S
Exact Mass 358.181395 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EjipTb3oZCd
Name (+-)-(2.alpha.,4.alpha.,4a.alpha.)-[1,2,3,4,4a,5,6,7-Octahydro-.alpha.,.alpha.,1,4a-tetramethyl-4-[(methylsulfonyl)oxy]-2-naphthalenyl]methyl Acetate
Alternate Name(s) 2-((2S,4S,4aS)-4-Methanesulfonyloxy-4a,8-dimethyl-1,2,3,4,4a,5,6,7-octahydro-naphthalen-2-yl)-2-methyl-propionic acid methyl ester Methyl 2-{(2R,4S,4aS)-1,4a-dimethyl-4-[(methylsulfonyl)oxy]-1,2,3,4,4a,5,6,7-octahydro-2-naphthalenyl}-2-methylpropanoate
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Formula C18H30O5S
InChI InChI=1S/C18H30O5S/c1-12-8-7-9-18(4)14(12)10-13(17(2,3)16(19)22-5)11-15(18)23-24(6,20)21/h13,15H,7-11H2,1-6H3/t13-,15-,18-/m0/s1
InChIKey MDQUQYHJBIZKEX-YEWWUXTCSA-N
Molecular Weight 358.493 g/mol
SMILES C=12[C@@]([C@@](OS(=O)(=O)C)(C[C@](C2)(C(C(=O)OC)(C)C)[H])[H])(CCCC1C)C
SPLASH splash10-0zg0-1940000000-6590be147c615a4d7951
Source of Spectrum J-62-2349-14
Wiley ID 1346927