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N-[(1'R,2'R,3'S,3a'R,7a'S)-2'-Hydroxy-5,5-dimethyl-1'-{(S)-N-methylphenyl-sulfonimidoyl}octahydrospiro[1,3-dioxane-2,5 -indene]-3-yl]-2-methylpropane-2-sulfonamide

View entire compound with spectra: 1 MS (GC)

N-[(1'R,2'R,3'S,3a'R,7a'S)-2'-Hydroxy-5,5-dimethyl-1'-{(S)-N-methylphenyl-sulfonimidoyl}octahydrospiro[1,3-dioxane-2,5 -indene]-3-yl]-2-methylpropane-2-sulfonamide
SpectraBase Compound ID 8BUwVFThWWj
InChI InChI=1S/C25H40N2O6S2/c1-23(2,3)35(30,31)27-20-19-14-25(32-15-24(4,5)16-33-25)13-12-18(19)22(21(20)28)34(29,26-6)17-10-8-7-9-11-17/h7-11,18-22,27-28H,12-16H2,1-6H3/t18-,19+,20-,21+,22+,34-/m0/s1
InChIKey FSFGTQRFPVJAIF-KBSAWCPJSA-N
Mol Weight 528.7 g/mol
Molecular Formula C25H40N2O6S2
Exact Mass 528.232779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9fcjrO9ptGw
Name N-[(1'R,2'R,3'S,3a'R,7a'S)-2'-Hydroxy-5,5-dimethyl-1'-{(S)-N-methylphenyl-sulfonimidoyl}octahydrospiro[1,3-dioxane-2,5 -indene]-3-yl]-2-methylpropane-2-sulfonamide
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H40N2O6S2
InChI InChI=1S/C25H40N2O6S2/c1-23(2,3)35(30,31)27-20-19-14-25(32-15-24(4,5)16-33-25)13-12-18(19)22(21(20)28)34(29,26-6)17-10-8-7-9-11-17/h7-11,18-22,27-28H,12-16H2,1-6H3/t18-,19+,20-,21+,22+,34-/m0/s1
InChIKey FSFGTQRFPVJAIF-KBSAWCPJSA-N
Molecular Weight 528.723 g/mol
SMILES N(S(C(C)(C)C)(=O)=O)[C@@]1([C@]([C@@]([C@@]2([C@]1(CC1(CC2)OCC(C)(C)CO1)[H])[H])([S@@](=NC)(=O)c1ccccc1)[H])(O)[H])[H]
SPLASH splash10-0udi-0790000000-8e7528e8c6a4d87f8d57
Source of Spectrum U1-2011-6001-14
Wiley ID 1688785