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ASCIDIATHIAZONE_B
SpectraBase Compound ID IUga06bkbo8
InChI InChI=1S/C12H6N2O6S/c15-9-5-1-2-6(12(17)18)14-7(5)10(16)11-8(9)13-3-4-21(11,19)20/h1-4,13H,(H,17,18)
InChIKey GDXFAPJBCPQOTL-UHFFFAOYSA-N
Mol Weight 306.25 g/mol
Molecular Formula C12H6N2O6S
Exact Mass 305.994657 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EDp1gm51O7d
Name ASCIDIATHIAZONE_B
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H6N2O6S
InChI InChI=1S/C12H6N2O6S/c15-9-5-1-2-6(12(17)18)14-7(5)10(16)11-8(9)13-3-4-21(11,19)20/h1-4,13H,(H,17,18)
InChIKey GDXFAPJBCPQOTL-UHFFFAOYSA-N
Literature Reference Author A.N.PEARCE,E.W.CHIA,M.V.BERRIDGE,G.R.CLARK,J.L.HARPER,L.LARS EN,E.W.MAAS,M.J.PAGE
Literature Reference Citation J.NAT.PROD.,70,936(2007)
Literature Reference DOI 10.1021/np060626o
Molecular Weight 306.249 g/mol
Sample ID 30404
Solvent DMSO-D6