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2-[4-(1,2-DIMETHYL-5-NITRO-1H-IMIDAZOL-4-YL)-PHENYL]-1-(3-NITROPHENYL)-ETHANOL

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2-[4-(1,2-DIMETHYL-5-NITRO-1H-IMIDAZOL-4-YL)-PHENYL]-1-(3-NITROPHENYL)-ETHANOL
SpectraBase Compound ID 66AkDOGc0Y7
InChI InChI=1S/C19H18N4O5/c1-12-20-18(19(21(12)2)23(27)28)14-8-6-13(7-9-14)10-17(24)15-4-3-5-16(11-15)22(25)26/h3-9,11,17,24H,10H2,1-2H3
InChIKey XXMIIALZSFYAPD-UHFFFAOYSA-N
Mol Weight 382.38 g/mol
Molecular Formula C19H18N4O5
Exact Mass 382.12772 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LiRjB7qCLbe
Name 2-[4-(1,2-DIMETHYL-5-NITRO-1H-IMIDAZOL-4-YL)-PHENYL]-1-(3-NITROPHENYL)-ETHANOL
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H18N4O5
InChI InChI=1S/C19H18N4O5/c1-12-20-18(19(21(12)2)23(27)28)14-8-6-13(7-9-14)10-17(24)15-4-3-5-16(11-15)22(25)26/h3-9,11,17,24H,10H2,1-2H3
InChIKey XXMIIALZSFYAPD-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 382.376 g/mol
Sample ID 72887
Solvent DMSO-D6