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2-(acetylamino)-4-chlorophenyl 4-tert-butylbenzenesulfonate
SpectraBase Compound ID FvCTQJPAwCP
InChI InChI=1S/C18H20ClNO4S/c1-12(21)20-16-11-14(19)7-10-17(16)24-25(22,23)15-8-5-13(6-9-15)18(2,3)4/h5-11H,1-4H3,(H,20,21)
InChIKey UZIBUZYAQLIFIR-UHFFFAOYSA-N
Mol Weight 381.87 g/mol
Molecular Formula C18H20ClNO4S
Exact Mass 381.080157 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8GfrwUgpsx8
Name 2-(acetylamino)-4-chlorophenyl 4-tert-butylbenzenesulfonate
Alternate Name(s) (2-acetamido-4-chloranyl-phenyl) 4-tert-butylbenzenesulfonate (2-acetamido-4-chloro-phenyl) 4-tert-butylbenzenesulfonate 4-tert-Butylbenzenesulfonic acid (2-acetamido-4-chloro-phenyl) ester 4-tert-Butylbenzenesulfonic acid, (2-acetylamino-4-chlorophenyl) ester 4-tert-Butylbenzenesulfonic acid (2-acetamido-4-chlorophenyl) ester
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Formula C18H20ClNO4S
InChI InChI=1S/C18H20ClNO4S/c1-12(21)20-16-11-14(19)7-10-17(16)24-25(22,23)15-8-5-13(6-9-15)18(2,3)4/h5-11H,1-4H3,(H,20,21)
InChIKey UZIBUZYAQLIFIR-UHFFFAOYSA-N
Molecular Weight 381.874 g/mol
SMILES N(c1c(OS(c2ccc(C(C)(C)C)cc2)(=O)=O)ccc(c1)Cl)C(=O)C
SPLASH splash10-0006-3900000000-9554aabfef3e0d996558
Wiley ID 1438759