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4-Methyl-N-[(1S,2R,3S,4R)-2-[oxidanyl(diphenyl)methyl]-7-oxabicyclo[2.2.1]heptan-3-yl]benzenesulfonamide
SpectraBase Compound ID LLeUbs2xkjA
InChI InChI=1S/C26H27NO4S/c1-18-12-14-21(15-13-18)32(29,30)27-25-23-17-16-22(31-23)24(25)26(28,19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-15,22-25,27-28H,16-17H2,1H3/t22-,23+,24-,25+/m0/s1
InChIKey KMOYGJRJPLUGFN-FQUZAXHOSA-N
Mol Weight 449.57 g/mol
Molecular Formula C26H27NO4S
Exact Mass 449.16608 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BdIYcj4JAZy
Name 4-Methyl-N-[(1S,2R,3S,4R)-2-[oxidanyl(diphenyl)methyl]-7-oxabicyclo[2.2.1]heptan-3-yl]benzenesulfonamide
Alternate Name(s) N-[(1S,2R,3S,4R)-2-[hydroxy(diphenyl)methyl]-7-oxabicyclo[2.2.1]heptan-3-yl]-4-methyl-benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H27NO4S
InChI InChI=1S/C26H27NO4S/c1-18-12-14-21(15-13-18)32(29,30)27-25-23-17-16-22(31-23)24(25)26(28,19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-15,22-25,27-28H,16-17H2,1H3/t22-,23+,24-,25+/m0/s1
InChIKey KMOYGJRJPLUGFN-FQUZAXHOSA-N
Molecular Weight 449.565 g/mol
SMILES N([C@]1([C@@](C(c2ccccc2)(c2ccccc2)O)([C@]2(O[C@@]1(CC2)[H])[H])[H])[H])S(c1ccc(cc1)C)(=O)=O
SPLASH splash10-08gl-2900000000-b95142fc7da87df4b900
Source of Spectrum F-53-8528-9
Wiley ID 802575