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Pentanamide, N-(5-amino-2-chlorophenyl)-2-[(3,5-dibromo-4-hydroxy-2-methylphenyl)amino]-4,4-dimethyl-3-oxo-
SpectraBase Compound ID AeG1Y4ZGyR2
InChI InChI=1S/C20H22Br2ClN3O3/c1-9-13(8-11(21)17(27)15(9)22)25-16(18(28)20(2,3)4)19(29)26-14-7-10(24)5-6-12(14)23/h5-8,16,25,27H,24H2,1-4H3,(H,26,29)
InChIKey ZSVXJYDARIMYFO-UHFFFAOYSA-N
Mol Weight 547.68 g/mol
Molecular Formula C20H22Br2ClN3O3
Exact Mass 544.971645 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H10XfbcJZCZ
Name Pentanamide, N-(5-amino-2-chlorophenyl)-2-[(3,5-dibromo-4-hydroxy-2-methylphenyl)amino]-4,4-dimethyl-3-oxo-
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Formula C20H22Br2ClN3O3
InChI InChI=1S/C20H22Br2ClN3O3/c1-9-13(8-11(21)17(27)15(9)22)25-16(18(28)20(2,3)4)19(29)26-14-7-10(24)5-6-12(14)23/h5-8,16,25,27H,24H2,1-4H3,(H,26,29)
InChIKey ZSVXJYDARIMYFO-UHFFFAOYSA-N
Molecular Weight 547.675 g/mol
SMILES N(c1cc(c(c(c1C)Br)O)Br)C(C(=O)Nc1cc(ccc1Cl)N)C(=O)C(C)(C)C
SPLASH splash10-001j-2931430000-333a4eeca4a6160e6200
Source of Spectrum JX-2015-4-1159
Synonyms N-(5-amino-2-chlorophenyl)-2-((3,5-dibromo-4-hydroxy-2-methylphenyl)amino)-4,4-dimethyl-3-oxopentanamide N-(5-amino-2-chlorophenyl)-N2-(3,5-dibromo-4-hydroxy-2-methylphenyl)-4-methyl-3-oxoleucinamide N-(5-amino-2-chlorophenyl)-2-(3,5-dibromo-4-hydroxy-2-methylanilino)-4,4-dimethyl-3-oxopentanamide N-(5-amino-2-chloro-phenyl)-2-(3,5-dibromo-4-hydroxy-2-methyl-anilino)-4,4-dimethyl-3-oxo-pentanamide N-(5-azanyl-2-chloranyl-phenyl)-2-[[3,5-bis(bromanyl)-2-methyl-4-oxidanyl-phenyl]amino]-4,4-dimethyl-3-oxidanylidene-pentanamide
Wiley ID 1726553