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(4'a.alpha.,5'.alpha.,8'-alpha.,8'a,alpha.)-octahydro-4'a,8'-dimethylspiro[1,3-dioxolane-2,2'(1'H)-naphthalene]-5',8'-diol 5'(methanesulfonate)

View entire compound with spectra: 1 MS (GC)

(4'a.alpha.,5'.alpha.,8'-alpha.,8'a,alpha.)-octahydro-4'a,8'-dimethylspiro[1,3-dioxolane-2,2'(1'H)-naphthalene]-5',8'-diol 5'(methanesulfonate)
SpectraBase Compound ID JNhGAWYyqYT
InChI InChI=1S/C15H26O6S/c1-13-6-7-15(19-8-9-20-15)10-11(13)14(2,16)5-4-12(13)21-22(3,17)18/h11-12,16H,4-10H2,1-3H3/t11-,12+,13+,14-/m0/s1
InChIKey FQLJTVDWZUTLDH-DGAVXFQQSA-N
Mol Weight 334.43 g/mol
Molecular Formula C15H26O6S
Exact Mass 334.14501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 36bsubnsl9r
Name (4'a.alpha.,5'.alpha.,8'-alpha.,8'a,alpha.)-octahydro-4'a,8'-dimethylspiro[1,3-dioxolane-2,2'(1'H)-naphthalene]-5',8'-diol 5'(methanesulfonate)
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Formula C15H26O6S
InChI InChI=1S/C15H26O6S/c1-13-6-7-15(19-8-9-20-15)10-11(13)14(2,16)5-4-12(13)21-22(3,17)18/h11-12,16H,4-10H2,1-3H3/t11-,12+,13+,14-/m0/s1
InChIKey FQLJTVDWZUTLDH-DGAVXFQQSA-N
Molecular Weight 334.427 g/mol
SMILES O[C@]1(CC[C@]([C@]2([C@@]1(CC1(CC2)OCCO1)[H])C)(OS(=O)(=O)C)[H])C
SPLASH splash10-007a-9130000000-c65337666d5560274687
Source of Spectrum J-59-381-1
Synonyms (4'aR,5'R,8'S,8'aS)-8'-hydroxy-4'a,8'-dimethyl-octahydro-1'H-spiro[1,3-dioxolane-2,2'-naphthalene]-5'-yl methanesulfonate Methanesulfonic acid (4'aR,5'R,8'S,8'aS)-8'-hydroxy-4'a,8'-dimethyl-octahydro-spiro[[1,3]dioxolane-2,2'-naphthalen]-5'-yl ester
Wiley ID 1330687