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[(3aR,7aS)-1,1-diketo-3a-(4-methoxyphenyl)-5,6-dimethyl-7,7a-dihydro-4H-1,2-benzothiazol-3-yl]-diethyl-amine
SpectraBase Compound ID UDQRDPRUU3
InChI InChI=1S/C20H28N2O3S/c1-6-22(7-2)19-20(16-8-10-17(25-5)11-9-16)13-15(4)14(3)12-18(20)26(23,24)21-19/h8-11,18H,6-7,12-13H2,1-5H3/t18-,20-/m0/s1
InChIKey AHXFYRBNPYRRSH-ICSRJNTNSA-N
Mol Weight 376.52 g/mol
Molecular Formula C20H28N2O3S
Exact Mass 376.182064 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DjJVazmQh7J
Name [(3aR,7aS)-1,1-diketo-3a-(4-methoxyphenyl)-5,6-dimethyl-7,7a-dihydro-4H-1,2-benzothiazol-3-yl]-diethyl-amine
Compound Number 10
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28N2O3S
InChI InChI=1S/C20H28N2O3S/c1-6-22(7-2)19-20(16-8-10-17(25-5)11-9-16)13-15(4)14(3)12-18(20)26(23,24)21-19/h8-11,18H,6-7,12-13H2,1-5H3/t18-,20-/m0/s1
InChIKey AHXFYRBNPYRRSH-ICSRJNTNSA-N
Literature Reference Author F.CLERICI,A.CASONI,M.L.GELMI,D.NAVA,S.PELLEGRINO,A.SALA
Literature Reference Citation EUR.J.ORG.CHEM.,4285(2006)
Molecular Weight 376.514 g/mol
Sample ID 33052
Solvent CDCl3