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Methyl (2R*/S*,4aR*,9bR*)-2-{[(Methylsulfonyl)oxy]methyl}-9b-phenyl-3,4,5,9b-tetrahydroindeno[1,2-b]pyran-4a(2H)-carboxylate Mesylate dev.
SpectraBase Compound ID CE6HvZJB3m3
InChI InChI=1S/C22H24O6S/c1-26-20(23)21-13-12-18(15-27-29(2,24)25)28-22(21,17-9-4-3-5-10-17)19-11-7-6-8-16(19)14-21/h3-11,18H,12-15H2,1-2H3/t18?,21-,22+/m0/s1
InChIKey GLXWKPUJCVZXQR-LFZQMPOYSA-N
Mol Weight 416.49 g/mol
Molecular Formula C22H24O6S
Exact Mass 416.12936 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 654QbJgYQ5D
Name Methyl (2R*/S*,4aR*,9bR*)-2-{[(Methylsulfonyl)oxy]methyl}-9b-phenyl-3,4,5,9b-tetrahydroindeno[1,2-b]pyran-4a(2H)-carboxylate Mesylate dev.
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Formula C22H24O6S
InChI InChI=1S/C22H24O6S/c1-26-20(23)21-13-12-18(15-27-29(2,24)25)28-22(21,17-9-4-3-5-10-17)19-11-7-6-8-16(19)14-21/h3-11,18H,12-15H2,1-2H3/t18?,21-,22+/m0/s1
InChIKey GLXWKPUJCVZXQR-LFZQMPOYSA-N
Molecular Weight 416.488 g/mol
SMILES [C@@]12([C@@](c3ccccc3C2)(OC(COS(=O)(=O)C)CC1)c1ccccc1)C(=O)OC
SPLASH splash10-0a4i-0009000000-88b46a0c49740f880b3c
Source of Spectrum K1-2004-2712-15
Synonyms Methyl (4aR,9bR)-2-{[(methylsulfonyl)oxy]methyl}-9b-phenyl-3,4,5,9b-tetrahydroindeno[1,2-b]pyran-4a(2H)-carboxylate
Wiley ID 1561131