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4-(2-NITROPHENYL)-3,6-DIOXAOCTANEDIOIC-ACID;2,2'-{[1-(2-NITROPHENYL)-ETHANE-1,2-DIYL]-BIS-(OXY)}-BIS-[ACETIC-ACID]
SpectraBase Compound ID JRsCM9zI8FU
InChI InChI=1S/C12H13NO8/c14-11(15)6-20-5-10(21-7-12(16)17)8-3-1-2-4-9(8)13(18)19/h1-4,10H,5-7H2,(H,14,15)(H,16,17)
InChIKey GLMOFEGDZGDFQQ-UHFFFAOYSA-N
Mol Weight 299.24 g/mol
Molecular Formula C12H13NO8
Exact Mass 299.064116 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 88dQGWRCk5
Name 4-(2-NITROPHENYL)-3,6-DIOXAOCTANEDIOIC-ACID;2,2'-{[1-(2-NITROPHENYL)-ETHANE-1,2-DIYL]-BIS-(OXY)}-BIS-[ACETIC-ACID]
Compound Number 7A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13NO8
InChI InChI=1S/C12H13NO8/c14-11(15)6-20-5-10(21-7-12(16)17)8-3-1-2-4-9(8)13(18)19/h1-4,10H,5-7H2,(H,14,15)(H,16,17)
InChIKey GLMOFEGDZGDFQQ-UHFFFAOYSA-N
Literature Reference Author R.WARMUTH,E.GRELL,J.M.LEHN,J.W.BATS,G.QUINKERT
Literature Reference Citation HELV.CHIM.ACTA,74,671(1991)
Literature Reference DOI 10.1002/hlca.19910740402
Molecular Weight 299.237 g/mol
Solvent CD3OD
Source File Reference UWVP5503