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(1R,9R,5R)-METHYL-10-OXO-3-THIO-2,4-DIAZA-6,11-DIOXATRICYCLO-[3.3.2.1.2(9,8)]-UNDECANE
SpectraBase Compound ID 80eQ6gRsm51
InChI InChI=1S/C8H10N2O3S/c1-8-4-5(9-7(14)10-8)3(2-12-8)13-6(4)11/h3-5H,2H2,1H3,(H2,9,10,14)/t3-,4-,5-,8+/m0/s1
InChIKey BLQRNROIVSKPFU-KALNXVOASA-N
Mol Weight 214.24 g/mol
Molecular Formula C8H10N2O3S
Exact Mass 214.041213 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 43DAXfA2nQy
Name (1R,9R,5R)-METHYL-10-OXO-3-THIO-2,4-DIAZA-6,11-DIOXATRICYCLO-[3.3.2.1.2(9,8)]-UNDECANE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H10N2O3S
InChI InChI=1S/C8H10N2O3S/c1-8-4-5(9-7(14)10-8)3(2-12-8)13-6(4)11/h3-5H,2H2,1H3,(H2,9,10,14)/t3-,4-,5-,8+/m0/s1
InChIKey BLQRNROIVSKPFU-KALNXVOASA-N
Literature Reference Author M.V.FERNANDEZ,F.J.L.HERRERA,T.L.COBOS
Literature Reference Citation HETEROCYCLES,24,679(1986)
Literature Reference DOI 10.3987/R-1986-03-0679
Molecular Weight 214.239 g/mol
Solvent D2O
Source File Reference UWED12293