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Ethyl 7-(4-Nitrobenzenesulfonyloxy)indole-2-carboxylate
SpectraBase Compound ID 9HGT8cRJ9Oq
InChI InChI=1S/C17H14N2O7S/c1-2-25-17(20)14-10-11-4-3-5-15(16(11)18-14)26-27(23,24)13-8-6-12(7-9-13)19(21)22/h3-10,18H,2H2,1H3
InChIKey TUDSZKYXTCNLPB-UHFFFAOYSA-N
Mol Weight 390.37 g/mol
Molecular Formula C17H14N2O7S
Exact Mass 390.052172 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5FUKR1ufGLg
Name Ethyl 7-(4-Nitrobenzenesulfonyloxy)indole-2-carboxylate
Alternate Name(s) ethyl 7-{[(4-nitrophenyl)sulfonyl]oxy}-1H-indole-2-carboxylate 7-(4-nitrophenyl)sulfonyloxy-1H-indole-2-carboxylic acid ethyl ester ethyl 7-(4-nitrophenyl)sulfonyloxy-1H-indole-2-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C17H14N2O7S
InChI InChI=1S/C17H14N2O7S/c1-2-25-17(20)14-10-11-4-3-5-15(16(11)18-14)26-27(23,24)13-8-6-12(7-9-13)19(21)22/h3-10,18H,2H2,1H3
InChIKey TUDSZKYXTCNLPB-UHFFFAOYSA-N
Molecular Weight 390.366 g/mol
SMILES [nH]1c(cc2cccc(c12)OS(c1ccc(N(=O)=O)cc1)(=O)=O)C(=O)OCC
SPLASH splash10-0udi-0093000000-99b779aa7cd0d9035780
Source of Spectrum PS-54-55-15
Wiley ID 805243