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Bis(1,1-dimethylethyl) 6-(Dimethylamino)-4-{[(4-methylphenyl)sulfonyl]amino}-5-phenylpyridine-2,3-dicarboxylate
SpectraBase Compound ID 5BiNB4dz2M0
InChI InChI=1S/C30H37N3O6S/c1-19-15-17-21(18-16-19)40(36,37)32-24-22(20-13-11-10-12-14-20)26(33(8)9)31-25(28(35)39-30(5,6)7)23(24)27(34)38-29(2,3)4/h10-18H,1-9H3,(H,31,32)
InChIKey ZQZMFMBCPIEFMK-UHFFFAOYSA-N
Mol Weight 567.7 g/mol
Molecular Formula C30H37N3O6S
Exact Mass 567.240307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5rt628brNyK
Name Bis(1,1-dimethylethyl) 6-(Dimethylamino)-4-{[(4-methylphenyl)sulfonyl]amino}-5-phenylpyridine-2,3-dicarboxylate
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Formula C30H37N3O6S
InChI InChI=1S/C30H37N3O6S/c1-19-15-17-21(18-16-19)40(36,37)32-24-22(20-13-11-10-12-14-20)26(33(8)9)31-25(28(35)39-30(5,6)7)23(24)27(34)38-29(2,3)4/h10-18H,1-9H3,(H,31,32)
InChIKey ZQZMFMBCPIEFMK-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201400255
Molecular Weight 567.701 g/mol
SMILES N(c1c(c(nc(c1-c1ccccc1)N(C)C)C(=O)OC(C)(C)C)C(OC(C)(C)C)=O)S(c1ccc(cc1)C)(=O)=O
SPLASH splash10-0pbc-1900100000-74d48ad31041a9bca227
Source of Spectrum H-98-537-6i
Synonyms di-tert-butyl 6-(dimethylamino)-4-((4-methylphenyl)sulfonamido)-5-phenylpyridine-2,3-dicarboxylate
Wiley ID 1786325