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[2-(4-NITROPHENYL-[N15]-ETHYLAMINO]-[13C2]-OXOACETIC-ACID-S-ETHYLESTER
SpectraBase Compound ID 9GbFl8C9X3R
InChI InChI=1S/C12H14N2O4S/c1-2-19-12(16)11(15)13-8-7-9-3-5-10(6-4-9)14(17)18/h3-6H,2,7-8H2,1H3,(H,13,15)/i11+1,12+1,13+1
InChIKey QKXYTOKDGGFDPX-AOBXNIALSA-N
Mol Weight 285.29 g/mol
Molecular Formula C1013C2H14N15NO4S
Exact Mass 285.071173 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8CiymJwzjlf
Name [2-(4-NITROPHENYL-[N15]-ETHYLAMINO]-[13C2]-OXOACETIC-ACID-S-ETHYLESTER
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H14N15NO4S
InChI InChI=1S/C12H14N2O4S/c1-2-19-12(16)11(15)13-8-7-9-3-5-10(6-4-9)14(17)18/h3-6H,2,7-8H2,1H3,(H,13,15)/i11+1,12+1,13+1
InChIKey QKXYTOKDGGFDPX-AOBXNIALSA-N
Literature Reference Author S.J.WEINER,S.M.HOLL,D.F.COVEY
Literature Reference Citation MAGN.RES.CHEM.,32,122(1994)
Literature Reference DOI 10.1002/mrc.1260320212
Solvent CDCl3
Source File Reference UWCP2346