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1-(2-Fluorophenyl)-7,7-dimethyl-4-(3-nitrophenyl)-3,4,6,8-tetrahydroquinoline-2,5-dione
SpectraBase Compound ID Gun2TYYXcz2
InChI InChI=1S/C23H21FN2O4/c1-23(2)12-19-22(20(27)13-23)16(14-6-5-7-15(10-14)26(29)30)11-21(28)25(19)18-9-4-3-8-17(18)24/h3-10,16H,11-13H2,1-2H3
InChIKey JRNVWWZILALKAE-UHFFFAOYSA-N
Mol Weight 408.43 g/mol
Molecular Formula C23H21FN2O4
Exact Mass 408.148535 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2g7hvBUI4gH
Name 1-(2-Fluorophenyl)-7,7-dimethyl-4-(3-nitrophenyl)-3,4,6,8-tetrahydroquinoline-2,5-dione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 408.148535323 u
Formula C23H21FN2O4
InChI InChI=1S/C23H21FN2O4/c1-23(2)12-19-22(20(27)13-23)16(14-6-5-7-15(10-14)26(29)30)11-21(28)25(19)18-9-4-3-8-17(18)24/h3-10,16H,11-13H2,1-2H3
InChIKey JRNVWWZILALKAE-UHFFFAOYSA-N
Molecular Weight 408.429 g/mol
SMILES C1C(CC=2N(C(CC(C2C1=O)C1=CC(=CC=C1)N(=O)=O)=O)C1=C(C=CC=C1)F)(C)C