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4-[(E)-2-NITROETHENYL]-PHENYL-HYDROGEN-GLUTARATE
SpectraBase Compound ID 7euoEyW7Dog
InChI InChI=1S/C13H13NO6/c15-12(16)2-1-3-13(17)20-11-6-4-10(5-7-11)8-9-14(18)19/h4-9H,1-3H2,(H,15,16)/b9-8+
InChIKey VDUFPPWXHOFREH-CMDGGOBGSA-N
Mol Weight 279.25 g/mol
Molecular Formula C13H13NO6
Exact Mass 279.074287 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9GrVqRiCuTO
Name 4-[(E)-2-NITROETHENYL]-PHENYL-HYDROGEN-GLUTARATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13NO6
InChI InChI=1S/C13H13NO6/c15-12(16)2-1-3-13(17)20-11-6-4-10(5-7-11)8-9-14(18)19/h4-9H,1-3H2,(H,15,16)/b9-8+
InChIKey VDUFPPWXHOFREH-CMDGGOBGSA-N
Literature Reference Author S.PETERLI,R.STUMPF,M.SCHWEIZER,U.SEQUIN,H.METT,P.TRAXLER
Literature Reference Citation HELV.CHIM.ACTA,75,696(1992)
Literature Reference DOI 10.1002/hlca.19920750304
Molecular Weight 279.249 g/mol
Solvent DMSO-D6
Source File Reference UWCS7607