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Diethyl 2,2-bis(2'-methyl-3'-indolyl)malonate
SpectraBase Compound ID KzzsWZCSoI9
InChI InChI=1S/C25H26N2O4/c1-5-30-23(28)25(24(29)31-6-2,21-15(3)26-19-13-9-7-11-17(19)21)22-16(4)27-20-14-10-8-12-18(20)22/h7-14,26-27H,5-6H2,1-4H3
InChIKey KYVLAFVFGYNUQG-UHFFFAOYSA-N
Mol Weight 418.49 g/mol
Molecular Formula C25H26N2O4
Exact Mass 418.189257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DecBijXjW5m
Name Diethyl 2,2-bis(2'-methyl-3'-indolyl)malonate
Alternate Name(s) Diethyl 2,2-bis(2-methyl-1H-indol-3-yl)malonate
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Formula C25H26N2O4
InChI InChI=1S/C25H26N2O4/c1-5-30-23(28)25(24(29)31-6-2,21-15(3)26-19-13-9-7-11-17(19)21)22-16(4)27-20-14-10-8-12-18(20)22/h7-14,26-27H,5-6H2,1-4H3
InChIKey KYVLAFVFGYNUQG-UHFFFAOYSA-N
Molecular Weight 418.493 g/mol
SMILES [nH]1c2c(c(C(c3c([nH]c4c3cccc4)C)(C(=O)OCC)C(=O)OCC)c1C)cccc2
SPLASH splash10-0002-0129300000-3e17edfe56a3b8012cd2
Source of Spectrum O1-65-45-3
Wiley ID 1592995