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(+)-[RS,1Z,N(1S),3S,4R]-N-[1-(HYDROXYMETHYL)-2-METHYLPROPYL]-3-METHYL-4-CYCLOHEXYL-1-(4-METHYLPHENYLSULFONIMIDOYL)-1-BUTENE-4-OL

View entire compound with spectra: 1 NMR

(+)-[RS,1Z,N(1S),3S,4R]-N-[1-(HYDROXYMETHYL)-2-METHYLPROPYL]-3-METHYL-4-CYCLOHEXYL-1-(4-METHYLPHENYLSULFONIMIDOYL)-1-BUTENE-4-OL
SpectraBase Compound ID 52zMjKhJGAh
InChI InChI=1S/C23H37NO3S/c1-17(2)22(16-25)24-28(27,21-12-10-18(3)11-13-21)15-14-19(4)23(26)20-8-6-5-7-9-20/h10-15,17,19-20,22-23,25-26H,5-9,16H2,1-4H3/b15-14-/t19-,22-,23-,28?/m0/s1
InChIKey NKRVEDMSDNNUOH-JLBISPBLSA-N
Mol Weight 407.6 g/mol
Molecular Formula C23H37NO3S
Exact Mass 407.249415 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2aUMcA0wFvr
Name (+)-[RS,1Z,N(1S),3S,4R]-N-[1-(HYDROXYMETHYL)-2-METHYLPROPYL]-3-METHYL-4-CYCLOHEXYL-1-(4-METHYLPHENYLSULFONIMIDOYL)-1-BUTENE-4-OL
Compound Number 20C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H37NO3S
InChI InChI=1S/C23H37NO3S/c1-17(2)22(16-25)24-28(27,21-12-10-18(3)11-13-21)15-14-19(4)23(26)20-8-6-5-7-9-20/h10-15,17,19-20,22-23,25-26H,5-9,16H2,1-4H3/b15-14-/t19-,22-,23-,28?/m0/s1
InChIKey NKRVEDMSDNNUOH-JLBISPBLSA-N
Literature Reference Author M.REGGELIN,H.WEINBERGER,M.GERLACH,R.WELCKER
Literature Reference Citation J.AM.CHEM.SOC.,118,4765(1996)
Literature Reference DOI 10.1021/ja9530735
Molecular Weight 407.612 g/mol
Sample ID 45882
Solvent CDCl3