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XRZVFTSZMSNWMB-UHFFFAOYSA-N
SpectraBase Compound ID LhfOFIwrojr
InChI InChI=1S/C9H16N2O4S/c1-5(9(14)15-3)10-8(13)7(4-16)11-6(2)12/h5,7,16H,4H2,1-3H3,(H,10,13)(H,11,12)
InChIKey XRZVFTSZMSNWMB-UHFFFAOYSA-N
Mol Weight 248.3 g/mol
Molecular Formula C9H16N2O4S
Exact Mass 248.083078 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FR7YFJhLIEc
Name XRZVFTSZMSNWMB-UHFFFAOYSA-N
CAS Registry Number 129119-17-1
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H16N2O4S
InChI InChI=1S/C9H16N2O4S/c1-5(9(14)15-3)10-8(13)7(4-16)11-6(2)12/h5,7,16H,4H2,1-3H3,(H,10,13)(H,11,12)
InChIKey XRZVFTSZMSNWMB-UHFFFAOYSA-N
Literature Reference Author M.GINANNESCHI,M.CHELLI,A.M.PAPINI,D.PINZANI,G.RAPI
Literature Reference Citation MAGN.RES.CHEM.,34,95(1996)
Literature Reference DOI 10.1002/(sici)1097-458x(199602)34:2<95::aid-omr855>3.0.co;2-v
Molecular Weight 248.297 g/mol
Solvent CDCl3
Source File Reference UWCP2320