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1-O,1-O-diethyl 2-O-methyl 1-phenyl-2-(selenadiazol-4-yl)ethane-1,1,2-tricarboxylate
SpectraBase Compound ID 1J5icHvH83p
InChI InChI=1S/C18H20N2O6Se/c1-4-25-16(22)18(17(23)26-5-2,12-9-7-6-8-10-12)14(15(21)24-3)13-11-27-20-19-13/h6-11,14H,4-5H2,1-3H3
InChIKey MTTMFLKVCUAWCN-UHFFFAOYSA-N
Mol Weight 439.34 g/mol
Molecular Formula C18H20N2O6Se
Exact Mass 440.048658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Jm4c9xh7qU
Name 1-O,1-O-diethyl 2-O-methyl 1-phenyl-2-(selenadiazol-4-yl)ethane-1,1,2-tricarboxylate
Alternate Name(s) 1-Phenyl-2-(4-selenadiazolyl)ethane-1,1,2-tricarboxylic acid O1,O1-diethyl ester O2-methyl ester 1-Phenyl-2-(selenadiazol-4-yl)ethane-1,1,2-tricarboxylic acid O1,O1-diethyl ester O2-methyl ester O1,O1-diethyl O2-methyl 1-phenyl-2-(1,2,3-selenadiazol-4-yl)ethane-1,1,2-tricarboxylate O1,O1-diethyl O2-methyl 1-phenyl-2-(selenadiazol-4-yl)ethane-1,1,2-tricarboxylate
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Formula C18H20N2O6Se
InChI InChI=1S/C18H20N2O6Se/c1-4-25-16(22)18(17(23)26-5-2,12-9-7-6-8-10-12)14(15(21)24-3)13-11-27-20-19-13/h6-11,14H,4-5H2,1-3H3
InChIKey MTTMFLKVCUAWCN-UHFFFAOYSA-N
Molecular Weight 439.338 g/mol
SMILES C(C(c1nn[se]c1)C(=O)OC)(C(=O)OCC)(C(=O)OCC)c1ccccc1
SPLASH splash10-0udi-0009200000-57bfc6281adac85f5923
Source of Spectrum F-68-1951-6
Wiley ID 1571956