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Benzoic acid, 4-[1-[[(2,5-dichlorophenyl)amino]carbonyl]-3,3-dimethyl-2-oxobutoxy]-
SpectraBase Compound ID 3V9tpG9nyvd
InChI InChI=1S/C20H19Cl2NO5/c1-20(2,3)17(24)16(28-13-7-4-11(5-8-13)19(26)27)18(25)23-15-10-12(21)6-9-14(15)22/h4-10,16H,1-3H3,(H,23,25)(H,26,27)
InChIKey GUPOJRJDKMQMPF-UHFFFAOYSA-N
Mol Weight 424.28 g/mol
Molecular Formula C20H19Cl2NO5
Exact Mass 423.064028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BuEInVulyPB
Name Benzoic acid, 4-[1-[[(2,5-dichlorophenyl)amino]carbonyl]-3,3-dimethyl-2-oxobutoxy]-
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Formula C20H19Cl2NO5
InChI InChI=1S/C20H19Cl2NO5/c1-20(2,3)17(24)16(28-13-7-4-11(5-8-13)19(26)27)18(25)23-15-10-12(21)6-9-14(15)22/h4-10,16H,1-3H3,(H,23,25)(H,26,27)
InChIKey GUPOJRJDKMQMPF-UHFFFAOYSA-N
Molecular Weight 424.280 g/mol
SMILES OC(c1ccc(OC(C(=O)Nc2cc(Cl)ccc2Cl)C(C(C)(C)C)=O)cc1)=O
SPLASH splash10-0nor-9811100000-9d179f5bb4bced073e74
Source of Spectrum JX-2015-4-302
Synonyms 4-((1-((2,5-dichlorophenyl)amino)-4,4-dimethyl-1,3-dioxopentan-2-yl)oxy)benzoic acid 4-({1-[(2,5-dichlorophenyl)amino]-4,4-dimethyl-1,3-dioxopentan-2-yl}oxy)benzoic acid 4-[1-(2,5-dichloroanilino)-4,4-dimethyl-1,3-dioxopentan-2-yl]oxybenzoic acid 4-[1-[(2,5-dichlorophenyl)carbamoyl]-3,3-dimethyl-2-oxo-butoxy]benzoic acid 4-[1-[[2,5-bis(chloranyl)phenyl]amino]-4,4-dimethyl-1,3-bis(oxidanylidene)pentan-2-yl]oxybenzoic acid
Wiley ID 1725749