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KAUOCGHCFWHWSI-DWTRPJMMSA-N
SpectraBase Compound ID A7w3v1ABnAV
InChI InChI=1S/C18H26N2O5S2/c1-4-5-11-25-17(21)13-19-18(22)16(10-12-26-3)20-27(23,24)15-8-6-14(2)7-9-15/h4-9,16,20H,10-13H2,1-3H3,(H,19,22)/b5-4+/t16-/m1/s1
InChIKey KAUOCGHCFWHWSI-DWTRPJMMSA-N
Mol Weight 414.54 g/mol
Molecular Formula C18H26N2O5S2
Exact Mass 414.128314 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KXuSX1EF2Yy
Name KAUOCGHCFWHWSI-DWTRPJMMSA-N
Compound Number 1H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H26N2O5S2
InChI InChI=1S/C18H26N2O5S2/c1-4-5-11-25-17(21)13-19-18(22)16(10-12-26-3)20-27(23,24)15-8-6-14(2)7-9-15/h4-9,16,20H,10-13H2,1-3H3,(H,19,22)/b5-4+/t16-/m1/s1
InChIKey KAUOCGHCFWHWSI-DWTRPJMMSA-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 414.535 g/mol
Sample ID 57888
Solvent CDCl3