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3-[(1,1-diketo-1,2-benzothiazol-3-yl)oxy]pentane-2,4-dione
SpectraBase Compound ID hETQlul2HP
InChI InChI=1S/C12H11NO5S/c1-7(14)11(8(2)15)18-12-9-5-3-4-6-10(9)19(16,17)13-12/h3-6,11H,1-2H3
InChIKey HJSVHCDPPIENIK-UHFFFAOYSA-N
Mol Weight 281.28 g/mol
Molecular Formula C12H11NO5S
Exact Mass 281.035794 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AgUWdVBcGMa
Name 3-[(1,1-diketo-1,2-benzothiazol-3-yl)oxy]pentane-2,4-dione
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H11NO5S
InChI InChI=1S/C12H11NO5S/c1-7(14)11(8(2)15)18-12-9-5-3-4-6-10(9)19(16,17)13-12/h3-6,11H,1-2H3
InChIKey HJSVHCDPPIENIK-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 281.283 g/mol
Source File Reference MHKO8863