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SMCKDCCSRXQPEU-SZBXFDNESA-N
SpectraBase Compound ID Clius5cJACg
InChI InChI=1S/C20H30N2O5S/c1-7-14(4)17(19(23)21-18(15(5)8-2)20(24)27-6)22-28(25,26)16-11-9-13(3)10-12-16/h8-12,14-15,17-18,22H,2,7H2,1,3-6H3,(H,21,23)/t14?,15?,17-,18?/m1/s1
InChIKey SMCKDCCSRXQPEU-SZBXFDNESA-N
Mol Weight 410.53 g/mol
Molecular Formula C20H30N2O5S
Exact Mass 410.187543 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CYqwCOcHC0U
Name SMCKDCCSRXQPEU-SZBXFDNESA-N
Compound Number 2F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H30N2O5S
InChI InChI=1S/C20H30N2O5S/c1-7-14(4)17(19(23)21-18(15(5)8-2)20(24)27-6)22-28(25,26)16-11-9-13(3)10-12-16/h8-12,14-15,17-18,22H,2,7H2,1,3-6H3,(H,21,23)/t14?,15?,17-,18?/m1/s1
InChIKey SMCKDCCSRXQPEU-SZBXFDNESA-N
Literature Reference Author U.KAZMAIER,S.MAIER
Literature Reference Citation J.ORG.CHEM.,64,4574(1999)
Literature Reference DOI 10.1021/jo9904821
Molecular Weight 410.529 g/mol
Sample ID 57894
Solvent CDCl3