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#6;1-[[(1R,2R,4S,4'S)-7,7-DIMETHYL-4'-[(NAPHTHALEN-1-YL-OXY)-METHYL]-SPIRO-[BICYCLO-[2.2.1]-HEPTANE-2,2'-[1,3]-DIOXOLANE]-1-YL]-METHYLSULFONYL]-PYRROLIDINE
SpectraBase Compound ID 4VCPMInpvY9
InChI InChI=1S/C27H35NO5S/c1-25(2)21-12-13-26(25,19-34(29,30)28-14-5-6-15-28)27(16-21)32-18-22(33-27)17-31-24-11-7-9-20-8-3-4-10-23(20)24/h3-4,7-11,21-22H,5-6,12-19H2,1-2H3/t21-,22-,26+,27-/m0/s1
InChIKey CTFXIZZEOHKOAF-ABMRFVCESA-N
Mol Weight 485.6 g/mol
Molecular Formula C27H35NO5S
Exact Mass 485.223594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6kbTy9DhjTv
Name #6;1-[[(1R,2R,4S,4'S)-7,7-DIMETHYL-4'-[(NAPHTHALEN-1-YL-OXY)-METHYL]-SPIRO-[BICYCLO-[2.2.1]-HEPTANE-2,2'-[1,3]-DIOXOLANE]-1-YL]-METHYLSULFONYL]-PYRROLIDINE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H35NO5S
InChI InChI=1S/C27H35NO5S/c1-25(2)21-12-13-26(25,19-34(29,30)28-14-5-6-15-28)27(16-21)32-18-22(33-27)17-31-24-11-7-9-20-8-3-4-10-23(20)24/h3-4,7-11,21-22H,5-6,12-19H2,1-2H3/t21-,22-,26+,27-/m0/s1
InChIKey CTFXIZZEOHKOAF-ABMRFVCESA-N
Literature Reference Author M.N.LOKHANDE,M.U.CHOPADE,D.N.BHANGARE,M.D.NIKALJE
Literature Reference Citation J.BRAZ.CHEM.SOC.,24,406(2013)
Literature Reference DOI 10.1590/s0103-50532013000300007
Molecular Weight 485.639 g/mol
Source File Reference UWBT5132