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4,5-Dichloro-10-(4-nitrobenzyl)-10H-anthracen-9-one
SpectraBase Compound ID E8vzY3iRnUw
InChI InChI=1S/C21H13Cl2NO3/c22-17-5-1-3-14-19(17)16(11-12-7-9-13(10-8-12)24(26)27)20-15(21(14)25)4-2-6-18(20)23/h1-10,16H,11H2
InChIKey DNVHPHKMHXPFBR-UHFFFAOYSA-N
Mol Weight 398.25 g/mol
Molecular Formula C21H13Cl2NO3
Exact Mass 397.027249 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5cHPTPxGF5E
Name 4,5-Dichloro-10-(4-nitrobenzyl)-10H-anthracen-9-one
Comments Less than 3 mono-isotopic peaks
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Formula C21H13Cl2NO3
InChI InChI=1S/C21H13Cl2NO3/c22-17-5-1-3-14-19(17)16(11-12-7-9-13(10-8-12)24(26)27)20-15(21(14)25)4-2-6-18(20)23/h1-10,16H,11H2
InChIKey DNVHPHKMHXPFBR-UHFFFAOYSA-N
Molecular Weight 398.245 g/mol
SMILES C1(c2c(c(Cl)ccc2)C(c2c1cccc2Cl)Cc1ccc(N(=O)=O)cc1)=O
SPLASH splash10-03di-0090000000-04a310da64fb27654d7f
Source of Spectrum F2-45-5283-5o
Synonyms 4,5-dichloro-10-[(4-nitrophenyl)methyl]-10H-anthracen-9-one
Wiley ID 1704035