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[(3aS,7aS)-1,1-diketo-5,6-dimethyl-3a,4,7,7a-tetrahydro-1,2-benzothiazol-3-yl]-(benzyl)amine
SpectraBase Compound ID FCgHkYAoqVO
InChI InChI=1S/C16H20N2O2S/c1-11-8-14-15(9-12(11)2)21(19,20)18-16(14)17-10-13-6-4-3-5-7-13/h3-7,14-15H,8-10H2,1-2H3,(H,17,18)/t14-,15+/m1/s1
InChIKey AFLODHLUHABRSV-CABCVRRESA-N
Mol Weight 304.41 g/mol
Molecular Formula C16H20N2O2S
Exact Mass 304.124549 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8LLwnKxIzZm
Name [(3aS,7aS)-1,1-diketo-5,6-dimethyl-3a,4,7,7a-tetrahydro-1,2-benzothiazol-3-yl]-(benzyl)amine
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H20N2O2S
InChI InChI=1S/C16H20N2O2S/c1-11-8-14-15(9-12(11)2)21(19,20)18-16(14)17-10-13-6-4-3-5-7-13/h3-7,14-15H,8-10H2,1-2H3,(H,17,18)/t14-,15+/m1/s1
InChIKey AFLODHLUHABRSV-CABCVRRESA-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 304.407 g/mol
Sample ID 33053
Solvent ACETONE-D6