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RAC-ETHYL-2,4-DIMETHYL-5-[3'-(4''-NITROPHENYL)-3'-OXO-1'-PHENYLPROPYL]-1H-PYRROLE-3-CARBOXYLATE
SpectraBase Compound ID BZjksNZDLYM
InChI InChI=1S/C24H24N2O5/c1-4-31-24(28)22-15(2)23(25-16(22)3)20(17-8-6-5-7-9-17)14-21(27)18-10-12-19(13-11-18)26(29)30/h5-13,20,25H,4,14H2,1-3H3/t20-/m0/s1
InChIKey BOQUAWCETWEUOL-FQEVSTJZSA-N
Mol Weight 420.47 g/mol
Molecular Formula C24H24N2O5
Exact Mass 420.168522 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JWsmdXfRwLh
Name RAC-ETHYL-2,4-DIMETHYL-5-[3'-(4''-NITROPHENYL)-3'-OXO-1'-PHENYLPROPYL]-1H-PYRROLE-3-CARBOXYLATE
Compound Number 1 6F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H24N2O5
InChI InChI=1S/C24H24N2O5/c1-4-31-24(28)22-15(2)23(25-16(22)3)20(17-8-6-5-7-9-17)14-21(27)18-10-12-19(13-11-18)26(29)30/h5-13,20,25H,4,14H2,1-3H3/t20-/m0/s1
InChIKey BOQUAWCETWEUOL-FQEVSTJZSA-N
Literature Reference Author R.LUEOEND,R.NEIER
Literature Reference Citation HELV.CHIM.ACTA,74,91(1991)
Molecular Weight 420.465 g/mol
Solvent DMSO-D6
Source File Reference UWVP5572