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Ethyl 4-[bis(phenylsulfonyl)amino]benzoate
SpectraBase Compound ID Hpw8zldTzAa
InChI InChI=1S/C21H19NO6S2/c1-2-28-21(23)17-13-15-18(16-14-17)22(29(24,25)19-9-5-3-6-10-19)30(26,27)20-11-7-4-8-12-20/h3-16H,2H2,1H3
InChIKey ZDHGNRSJEZLPKE-UHFFFAOYSA-N
Mol Weight 445.5 g/mol
Molecular Formula C21H19NO6S2
Exact Mass 445.06538 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HipOk3RTA6F
Name Ethyl 4-[bis(phenylsulfonyl)amino]benzoate
Alternate Name(s) 4-[bis(benzenesulfonyl)amino]benzoic acid ethyl ester Ethyl 4-[bis(benzenesulfonyl)amino]benzoate
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Formula C21H19NO6S2
InChI InChI=1S/C21H19NO6S2/c1-2-28-21(23)17-13-15-18(16-14-17)22(29(24,25)19-9-5-3-6-10-19)30(26,27)20-11-7-4-8-12-20/h3-16H,2H2,1H3
InChIKey ZDHGNRSJEZLPKE-UHFFFAOYSA-N
Molecular Weight 445.504 g/mol
SMILES C(c1ccc(cc1)N(S(=O)(=O)c1ccccc1)S(=O)(=O)c1ccccc1)(=O)OCC
SPLASH splash10-002g-7800900000-cd38293958dea582f110
Source of Spectrum E2-47-811-3
Wiley ID 1554889