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(TRANS,TRANS)-N-(4-NITROPHENETHYL)-1-PHENYL-3-PYRROL-1-YLINDAN-2-CARBOXYAMIDE
SpectraBase Compound ID EKYa5nkEXl
InChI InChI=1S/C28H25N3O3/c32-28(29-17-16-20-12-14-22(15-13-20)31(33)34)26-25(21-8-2-1-3-9-21)23-10-4-5-11-24(23)27(26)30-18-6-7-19-30/h1-15,18-19,25-27H,16-17H2,(H,29,32)/t25-,26+,27+/m0/s1
InChIKey DIYODIOAPABWJS-OYUWMTPXSA-N
Mol Weight 451.53 g/mol
Molecular Formula C28H25N3O3
Exact Mass 451.189592 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 38GM6pR62wW
Name (TRANS,TRANS)-N-(4-NITROPHENETHYL)-1-PHENYL-3-PYRROL-1-YLINDAN-2-CARBOXYAMIDE
Compound Number 2H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H25N3O3
InChI InChI=1S/C28H25N3O3/c32-28(29-17-16-20-12-14-22(15-13-20)31(33)34)26-25(21-8-2-1-3-9-21)23-10-4-5-11-24(23)27(26)30-18-6-7-19-30/h1-15,18-19,25-27H,16-17H2,(H,29,32)/t25-,26+,27+/m0/s1
InChIKey DIYODIOAPABWJS-OYUWMTPXSA-N
Literature Reference Author J.GUILLON,P.DALLEMAGNE,J.M.LEGER,J.SOPKOVA,P.R.BOVY,C.JARRY, S.RAULT
Literature Reference Citation BIOORG.MED.CHEM.,10,1043(2002)
Literature Reference DOI 10.1016/S0968-0896(01)00360-1
Molecular Weight 451.525 g/mol
Solvent CDCl3
Source File Reference UWLU31015