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Di-(2-methyl-butyl) 3,3'-bis(t-butyl)-4,4'-dimethyl-2,2'-bipyrrole-5,5'-dicarboxylate
SpectraBase Compound ID 6lwBErm0ZIe
InChI InChI=1S/C30H48N2O4/c1-13-17(3)15-35-27(33)23-19(5)21(29(7,8)9)25(31-23)26-22(30(10,11)12)20(6)24(32-26)28(34)36-16-18(4)14-2/h17-18,31-32H,13-16H2,1-12H3
InChIKey IJPWCHFAOPNATK-UHFFFAOYSA-N
Mol Weight 500.7 g/mol
Molecular Formula C30H48N2O4
Exact Mass 500.361408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9iWjtS9AAkJ
Name Di-(2-methyl-butyl) 3,3'-bis(t-butyl)-4,4'-dimethyl-2,2'-bipyrrole-5,5'-dicarboxylate
Alternate Name(s) 2-Methylbutyl 4-tert-butyl-5-{3-tert-butyl-4-methyl-5-[(2-methylbutoxy)carbonyl]-1H-pyrrol-2-yl}-3-methyl-1H-pyrrole-2-carboxylate Diisobutyl 3,3'-bis(t-butyl)-4,4'-dimethyl-2,2'-bipyrrole-5,5'-dicarboxylate
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Formula C30H48N2O4
InChI InChI=1S/C30H48N2O4/c1-13-17(3)15-35-27(33)23-19(5)21(29(7,8)9)25(31-23)26-22(30(10,11)12)20(6)24(32-26)28(34)36-16-18(4)14-2/h17-18,31-32H,13-16H2,1-12H3
InChIKey IJPWCHFAOPNATK-UHFFFAOYSA-N
Molecular Weight 500.724 g/mol
SMILES [nH]1c(-c2c(c(c([nH]2)C(OCC(CC)C)=O)C)C(C)(C)C)c(c(C)c1C(OCC(CC)C)=O)C(C)(C)C
SPLASH splash10-0pb9-4066290000-e3e41821208cfca0382b
Source of Spectrum AH-134-896-7
Wiley ID 1546928