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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 64fjALS8Qzl
Name 4-[4-(4-CHLOROPHENYLSULFONYL)PHTHALIMIDO]BENZOIC ACID
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. 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 441.0071
SMILES OC(=O)c1ccc(cc1)N1C(=O)c2cc(S(c3ccc(Cl)cc3)(=O)=O)ccc2C1=O
SPLASH splash10-0fc9-9500000000-76b1a909064f3b16b4ad
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany