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2-[4-(1,2-DIMETHYL-5-NITRO-1H-IMIDAZOL-4-YL)-BENZYL]-2-HYDROXY-ACENAPHTHYLEN-1(2H)-ONE
SpectraBase Compound ID 6u4rx9Br6lf
InChI InChI=1S/C24H19N3O4/c1-14-25-21(23(26(14)2)27(30)31)17-11-9-15(10-12-17)13-24(29)19-8-4-6-16-5-3-7-18(20(16)19)22(24)28/h3-12,29H,13H2,1-2H3
InChIKey VZCMRIQEQBSLKO-UHFFFAOYSA-N
Mol Weight 413.43 g/mol
Molecular Formula C24H19N3O4
Exact Mass 413.137556 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DlSNT7GSoGi
Name 2-[4-(1,2-DIMETHYL-5-NITRO-1H-IMIDAZOL-4-YL)-BENZYL]-2-HYDROXY-ACENAPHTHYLEN-1(2H)-ONE
Compound Number 3L
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H19N3O4
InChI InChI=1S/C24H19N3O4/c1-14-25-21(23(26(14)2)27(30)31)17-11-9-15(10-12-17)13-24(29)19-8-4-6-16-5-3-7-18(20(16)19)22(24)28/h3-12,29H,13H2,1-2H3
InChIKey VZCMRIQEQBSLKO-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 413.433 g/mol
Sample ID 72897
Solvent DMSO-D6