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4,5-Dichloro-10-(2,4-dinitrobenzyl)-10H-anthracen-9-one
SpectraBase Compound ID HCM8gBFnWeK
InChI InChI=1S/C21H12Cl2N2O5/c22-16-5-1-3-13-19(16)15(20-14(21(13)26)4-2-6-17(20)23)9-11-7-8-12(24(27)28)10-18(11)25(29)30/h1-8,10,15H,9H2
InChIKey PVQHURZPVCSKRQ-UHFFFAOYSA-N
Mol Weight 443.24 g/mol
Molecular Formula C21H12Cl2N2O5
Exact Mass 442.012327 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGbIFECGevT
Name 4,5-Dichloro-10-(2,4-dinitrobenzyl)-10H-anthracen-9-one
Comments Less than 3 mono-isotopic peaks
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Formula C21H12Cl2N2O5
InChI InChI=1S/C21H12Cl2N2O5/c22-16-5-1-3-13-19(16)15(20-14(21(13)26)4-2-6-17(20)23)9-11-7-8-12(24(27)28)10-18(11)25(29)30/h1-8,10,15H,9H2
InChIKey PVQHURZPVCSKRQ-UHFFFAOYSA-N
Molecular Weight 443.242 g/mol
SMILES C1(c2c(c(Cl)ccc2)C(c2c1cccc2Cl)Cc1c(N(=O)=O)cc(N(=O)=O)cc1)=O
SPLASH splash10-03di-0090000000-50bd17ff179180fc9737
Source of Spectrum F2-45-5283-5p
Synonyms 4,5-dichloro-10-[(2,4-dinitrophenyl)methyl]-10H-anthracen-9-one
Wiley ID 1704034