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1-Pentanone, 4-hydroxy-4-methyl-1-phenyl-, (2,4-dinitrophenyl)hydrazone
SpectraBase Compound ID HAurWJJOXmi
InChI InChI=1S/C18H20N4O5/c1-18(2,23)11-10-15(13-6-4-3-5-7-13)19-20-16-9-8-14(21(24)25)12-17(16)22(26)27/h3-9,12,20,23H,10-11H2,1-2H3/b19-15+
InChIKey SZBKGONPABHQPK-XDJHFCHBSA-N
Mol Weight 372.38 g/mol
Molecular Formula C18H20N4O5
Exact Mass 372.14337 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DuoPFfR1AZ0
Name 1-Pentanone, 4-hydroxy-4-methyl-1-phenyl-, (2,4-dinitrophenyl)hydrazone
Comments Computed using HOSE algorithm
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Exact Mass 372.143369755 u
Formula C18H20N4O5
InChI InChI=1S/C18H20N4O5/c1-18(2,23)11-10-15(13-6-4-3-5-7-13)19-20-16-9-8-14(21(24)25)12-17(16)22(26)27/h3-9,12,20,23H,10-11H2,1-2H3/b19-15+
InChIKey SZBKGONPABHQPK-XDJHFCHBSA-N
Molecular Weight 372.381 g/mol
SMILES C1(=CC=CC=C1)\C(=N\NC1=C(C=C(C=C1)N(=O)=O)N(=O)=O)CCC(C)(O)C