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(1R,2R)-(+)-1,2-(5,5'-Dimethyl-2,2'-dihydroxydibenzenesulfonamido)cyclohexane
SpectraBase Compound ID E9CqJXh9G9x
InChI InChI=1S/C20H26N2O6S2/c1-13-7-9-17(23)19(11-13)29(25,26)21-15-5-3-4-6-16(15)22-30(27,28)20-12-14(2)8-10-18(20)24/h7-12,15-16,21-24H,3-6H2,1-2H3/t15-,16-/m1/s1
InChIKey FOMWARDTGKFVQI-HZPDHXFCSA-N
Mol Weight 454.56 g/mol
Molecular Formula C20H26N2O6S2
Exact Mass 454.123229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2mRWO5FPE9
Name (1R,2R)-(+)-1,2-(5,5'-Dimethyl-2,2'-dihydroxydibenzenesulfonamido)cyclohexane
Alternate Name(s) 2-Hydroxy-N-((1R,2R)-2-{[(2-hydroxy-5-methylphenyl)sulfonyl]amino}cyclohexyl)-5-methylbenzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26N2O6S2
InChI InChI=1S/C20H26N2O6S2/c1-13-7-9-17(23)19(11-13)29(25,26)21-15-5-3-4-6-16(15)22-30(27,28)20-12-14(2)8-10-18(20)24/h7-12,15-16,21-24H,3-6H2,1-2H3/t15-,16-/m1/s1
InChIKey FOMWARDTGKFVQI-HZPDHXFCSA-N
Molecular Weight 454.556 g/mol
SMILES Oc1c(S(N[C@]2([C@](NS(c3c(ccc(c3)C)O)(=O)=O)(CCCC2)[H])[H])(=O)=O)cc(cc1)C
SPLASH splash10-0002-9000100000-cd90a06aab38a13ce053
Source of Spectrum F-53-4155-5
Wiley ID 801279