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4-[4-(4-Chlorophenylsulfonyl)phthalimido]benzoic acid
SpectraBase Compound ID H51PrFoTayD
InChI InChI=1S/C21H12ClNO6S/c22-13-3-7-15(8-4-13)30(28,29)16-9-10-17-18(11-16)20(25)23(19(17)24)14-5-1-12(2-6-14)21(26)27/h1-11H,(H,26,27)
InChIKey FCLGBWJQNONHQZ-UHFFFAOYSA-N
Mol Weight 441.84 g/mol
Molecular Formula C21H12ClNO6S
Exact Mass 441.007386 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7cIcMfkE8li
Name 4-[4-(4-Chlorophenylsulfonyl)phthalimido]benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H12ClNO6S
InChI InChI=1S/C21H12ClNO6S/c22-13-3-7-15(8-4-13)30(28,29)16-9-10-17-18(11-16)20(25)23(19(17)24)14-5-1-12(2-6-14)21(26)27/h1-11H,(H,26,27)
InChIKey FCLGBWJQNONHQZ-UHFFFAOYSA-N
Molecular Weight 441.841 g/mol
SMILES OC(c1ccc(N2C(c3ccc(cc3C2=O)S(=O)(=O)c2ccc(cc2)Cl)=O)cc1)=O
SPLASH splash10-0fc9-9500000000-f99451db390f078b23d7
Synonyms 4-(5-[(4-Chlorophenyl)sulfonyl]-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzoic acid 4-[5-(4-chlorophenyl)sulfonyl-1,3-bis(oxidanylidene)isoindol-2-yl]benzoic acid 4-[5-(4-chlorophenyl)sulfonyl-1,3-diketo-isoindolin-2-yl]benzoic acid 4-[5-(4-chlorophenyl)sulfonyl-1,3-dioxo-2-isoindolyl]benzoic acid 4-[5-(4-chlorophenyl)sulfonyl-1,3-dioxo-isoindolin-2-yl]benzoic acid 4-[5-(4-chlorophenyl)sulfonyl-1,3-dioxoisoindol-2-yl]benzoic acid
Wiley ID 1470138