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[(1S,2R,8aS)-2,5,5,8a-tetramethyl-2-(oxan-2-yloxy)-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]methyl methanesulfonate
SpectraBase Compound ID 3OYtOyDUmiC
InChI InChI=1S/C21H38O5S/c1-19(2)11-8-12-20(3)16(19)10-13-21(4,17(20)15-25-27(5,22)23)26-18-9-6-7-14-24-18/h16-18H,6-15H2,1-5H3/t16?,17-,18?,20+,21-/m1/s1
InChIKey PSDUIEJHDJWDLF-UTCPSUIVSA-N
Mol Weight 402.6 g/mol
Molecular Formula C21H38O5S
Exact Mass 402.243995 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ar0dytGAfxh
Name [(1S,2R,8aS)-2,5,5,8a-tetramethyl-2-(oxan-2-yloxy)-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]methyl methanesulfonate
Alternate Name(s) [(1S,2R,8aS)-2,5,5,8a-tetramethyl-2-tetrahydropyran-2-yloxy-decalin-1-yl]methyl methanesulfonate Methanesulfonic acid [(1S,2R,8aS)-2,5,5,8a-tetramethyl-2-(2-oxanyloxy)-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]methyl ester
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Formula C21H38O5S
InChI InChI=1S/C21H38O5S/c1-19(2)11-8-12-20(3)16(19)10-13-21(4,17(20)15-25-27(5,22)23)26-18-9-6-7-14-24-18/h16-18H,6-15H2,1-5H3/t16?,17-,18?,20+,21-/m1/s1
InChIKey PSDUIEJHDJWDLF-UTCPSUIVSA-N
Molecular Weight 402.590 g/mol
SMILES [C@]12([C@]([C@@](OC3OCCCC3)(C)CCC1C(C)(C)CCC2)(COS(=O)(=O)C)[H])C
SPLASH splash10-0a4i-0091000000-1a6c42a74e92832c2923
Source of Spectrum QC-7-1700-4
Wiley ID 869240