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Cyclohexanone, 2,6-bis[(3-nitrophenyl)methylene]-

View entire compound with spectra: 1 NMR

Cyclohexanone, 2,6-bis[(3-nitrophenyl)methylene]-
SpectraBase Compound ID 4hrNuH2PFQL
InChI InChI=1S/C20H16N2O5/c23-20-16(10-14-4-1-8-18(12-14)21(24)25)6-3-7-17(20)11-15-5-2-9-19(13-15)22(26)27/h1-2,4-5,8-13H,3,6-7H2/b16-10+,17-11+
InChIKey YXADDWKSFJIQJN-OTYYAQKOSA-N
Mol Weight 364.36 g/mol
Molecular Formula C20H16N2O5
Exact Mass 364.105922 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KIH60FIfdKM
Name Cyclohexanone, 2,6-bis[(3-nitrophenyl)methylene]-
Comments Computed using HOSE algorithm
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Exact Mass 364.105921618 u
Formula C20H16N2O5
InChI InChI=1S/C20H16N2O5/c23-20-16(10-14-4-1-8-18(12-14)21(24)25)6-3-7-17(20)11-15-5-2-9-19(13-15)22(26)27/h1-2,4-5,8-13H,3,6-7H2/b16-10+,17-11+
InChIKey YXADDWKSFJIQJN-OTYYAQKOSA-N
Molecular Weight 364.357 g/mol
SMILES C1\C(C(\C(CC1)=C\C1=CC(=CC=C1)N(=O)=O)=O)=C/C1=CC=CC(=C1)N(=O)=O