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5-bromo-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2-hydroxy-6-methoxy-3-nitrobenzamide
SpectraBase Compound ID 9JXb52jNmks
InChI InChI=1S/C15H20BrN3O5/c1-3-18-6-4-5-9(18)8-17-15(21)12-13(20)11(19(22)23)7-10(16)14(12)24-2/h7,9,20H,3-6,8H2,1-2H3,(H,17,21)/t9-/m0/s1
InChIKey SNGKPYYHFVHCDK-VIFPVBQESA-N
Mol Weight 402.25 g/mol
Molecular Formula C15H20BrN3O5
Exact Mass 401.058634 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LLmdmrN9pZp
Name 5-bromo-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2-hydroxy-6-methoxy-3-nitrobenzamide
Compound Number 94
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H20BrN3O5
InChI InChI=1S/C15H20BrN3O5/c1-3-18-6-4-5-9(18)8-17-15(21)12-13(20)11(19(22)23)7-10(16)14(12)24-2/h7,9,20H,3-6,8H2,1-2H3,(H,17,21)/t9-/m0/s1
InChIKey SNGKPYYHFVHCDK-VIFPVBQESA-N
Literature Reference Author T.DEPAULIS,N.ELTAYAR,P.A.CARRUPT,B.TESTA,H.VANDEWATERBEEMD
Literature Reference Citation HELV.CHIM.ACTA,74,241(1991)
Literature Reference DOI 10.1002/hlca.19910740124
Molecular Weight 402.245 g/mol
Solvent CDCl3
Source File Reference UWVP6079