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7,7-Dimethyl-6-(4-methylphenylsulfonyl)-exo-anti,8-bis[4-methylphenylsulfonyloxy]-6-azabicyclo[3.2.1]octane
SpectraBase Compound ID EK1jDOjZKNL
InChI InChI=1S/C30H35NO8S3/c1-21-9-15-24(16-10-21)40(32,33)31-28-8-6-7-27(29(31,4)5)30(28,38-41(34,35)25-17-11-22(2)12-18-25)39-42(36,37)26-19-13-23(3)14-20-26/h9-20,27-28H,6-8H2,1-5H3/t27-,28+/m1/s1
InChIKey UQJLBADVGGGHIM-UHFFFAOYSA-N
Mol Weight 633.8 g/mol
Molecular Formula C30H35NO8S3
Exact Mass 633.152481 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AO3DSJ8O28m
Name 7,7-Dimethyl-6-(4-methylphenylsulfonyl)-exo-anti,8-bis[4-methylphenylsulfonyloxy]-6-azabicyclo[3.2.1]octane
CAS Registry Number 109638-36-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H35NO8S3
InChI InChI=1S/C30H35NO8S3/c1-21-9-15-24(16-10-21)40(32,33)31-28-8-6-7-27(29(31,4)5)30(28,38-41(34,35)25-17-11-22(2)12-18-25)39-42(36,37)26-19-13-23(3)14-20-26/h9-20,27-28H,6-8H2,1-5H3/t27-,28+/m1/s1
InChIKey UQJLBADVGGGHIM-UHFFFAOYSA-N
Molecular Weight 633.789 g/mol
SMILES C1([C@]2(N(S(c3ccc(cc3)C)(=O)=O)C([C@]1(CCC2)[H])(C)C)[H])(OS(c1ccc(cc1)C)(=O)=O)OS(c1ccc(cc1)C)(=O)=O
SPLASH splash10-05am-5922503000-e89bd1bf24de9fae5ff9
Source of Spectrum K-120-1777-15
Synonyms 7,7-Dimethyl-6-[(4-methylphenyl)sulfonyl]-8-{[(4-methylphenyl)sulfonyl]oxy}-6-azabicyclo[3.2.1]oct-8-yl 4-methylbenzenesulfonate
Wiley ID 203302