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2,2-bis(1-methyl-3-indolyl)propanedioic acid diethyl ester
SpectraBase Compound ID 6OAVrpKQ3Vm
InChI InChI=1S/C25H26N2O4/c1-5-30-23(28)25(24(29)31-6-2,19-15-26(3)21-13-9-7-11-17(19)21)20-16-27(4)22-14-10-8-12-18(20)22/h7-16H,5-6H2,1-4H3
InChIKey NCVBIHYTIBJIHL-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 39LwE5VmmKb
Name 2,2-bis(1-methyl-3-indolyl)propanedioic acid diethyl ester
CAS Registry Number 127744-45-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H26N2O4
InChI InChI=1S/C25H26N2O4/c1-5-30-23(28)25(24(29)31-6-2,19-15-26(3)21-13-9-7-11-17(19)21)20-16-27(4)22-14-10-8-12-18(20)22/h7-16H,5-6H2,1-4H3
InChIKey NCVBIHYTIBJIHL-UHFFFAOYSA-N
Molecular Weight 418.493 g/mol
SMILES C(c1c[n](C)c2c1cccc2)(c1c[n](C)c2c1cccc2)(C(=O)OCC)C(=O)OCC
SPLASH splash10-014j-0229600000-e4f0343df285448cab06
Source of Spectrum O1-65-45-3
Synonyms 2,2-bis(1-methylindol-3-yl)malonic acid diethyl ester Diethyl 2,2-bis(1-methylindol-3-yl)propanedioate
Wiley ID 1592996