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TERT.-BUTYL-6-ALPHA-CHLOROPENICILLANATE-SULFONE
SpectraBase Compound ID 8ZEPqAPUEln
InChI InChI=1S/C12H18ClNO5S/c1-11(2,3)19-10(16)7-12(4,5)20(17,18)9-6(13)8(15)14(7)9/h6-7,9H,1-5H3/t6-,7-,9+/m1/s1
InChIKey FHCQOGAGQOBAHB-BHNWBGBOSA-N
Mol Weight 323.79 g/mol
Molecular Formula C12H18ClNO5S
Exact Mass 323.059422 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GTL17fwYRGd
Name TERT.-BUTYL-6-ALPHA-CHLOROPENICILLANATE-SULFONE
Compound Number 6C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H18ClNO5S
InChI InChI=1S/C12H18ClNO5S/c1-11(2,3)19-10(16)7-12(4,5)20(17,18)9-6(13)8(15)14(7)9/h6-7,9H,1-5H3/t6-,7-,9+/m1/s1
InChIKey FHCQOGAGQOBAHB-BHNWBGBOSA-N
Literature Reference Author C.E.BOSCHETTI,E.G.MATA,O.A.MASCARETTI,J.A.CRICCO,G.COUX,A.LO DEYRO,O.A.ROVERI
Literature Reference Citation J.BRAZ.CHEM.SOC.,7,285(1996)
Literature Reference DOI 10.5935/0103-5053.19960057
Molecular Weight 323.792 g/mol
Solvent CDCl3
Source File Reference UWPA1161