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1-[4-(1,2-DIMETHYL-5-NITRO-1H-IMIDAZOL-4-YL)-PHENYL]-2-(4-NITROPHENYL)-PROPAN-2-OL

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1-[4-(1,2-DIMETHYL-5-NITRO-1H-IMIDAZOL-4-YL)-PHENYL]-2-(4-NITROPHENYL)-PROPAN-2-OL
SpectraBase Compound ID KUWwYo0zi2a
InChI InChI=1S/C20H20N4O5/c1-13-21-18(19(22(13)3)24(28)29)15-6-4-14(5-7-15)12-20(2,25)16-8-10-17(11-9-16)23(26)27/h4-11,25H,12H2,1-3H3
InChIKey KSXYHVRSYGUUTB-UHFFFAOYSA-N
Mol Weight 396.4 g/mol
Molecular Formula C20H20N4O5
Exact Mass 396.14337 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H5gb7t5dQzC
Name 1-[4-(1,2-DIMETHYL-5-NITRO-1H-IMIDAZOL-4-YL)-PHENYL]-2-(4-NITROPHENYL)-PROPAN-2-OL
Compound Number 3M
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H20N4O5
InChI InChI=1S/C20H20N4O5/c1-13-21-18(19(22(13)3)24(28)29)15-6-4-14(5-7-15)12-20(2,25)16-8-10-17(11-9-16)23(26)27/h4-11,25H,12H2,1-3H3
InChIKey KSXYHVRSYGUUTB-UHFFFAOYSA-N
Literature Reference Author T.JUSPIN,L.ZINK,M.D.CROZET,T.TERME,P.VANELLE
Literature Reference Citation MOLECULES,16,6883(2011)
Literature Reference DOI 10.3390/molecules16086883
Molecular Weight 396.403 g/mol
Sample ID 72898
Solvent CDCl3