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2-(4-METHOXYPHENYLCARBAMOYL)-3,6-DINITROBENZOIC-ACID
SpectraBase Compound ID LeUxW3wx2YM
InChI InChI=1S/C15H11N3O8/c1-26-9-4-2-8(3-5-9)16-14(19)12-10(17(22)23)6-7-11(18(24)25)13(12)15(20)21/h2-7H,1H3,(H,16,19)(H,20,21)
InChIKey NWGUUPBYPGTZAA-UHFFFAOYSA-N
Mol Weight 361.27 g/mol
Molecular Formula C15H11N3O8
Exact Mass 361.054614 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FctOwcGQ7gO
Name 2-(4-METHOXYPHENYLCARBAMOYL)-3,6-DINITROBENZOIC-ACID
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H11N3O8
InChI InChI=1S/C15H11N3O8/c1-26-9-4-2-8(3-5-9)16-14(19)12-10(17(22)23)6-7-11(18(24)25)13(12)15(20)21/h2-7H,1H3,(H,16,19)(H,20,21)
InChIKey NWGUUPBYPGTZAA-UHFFFAOYSA-N
Literature Reference Author M.HAVLIK,V.KRAL,B.DOLENSKY
Literature Reference Citation ORG.LETTERS,8,4867(2006)
Literature Reference DOI 10.1021/ol061913m
Molecular Weight 361.268 g/mol
Sample ID 60794
Solvent DMSO-D6