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3-Methyl-3-(2-phenylcarbamoylallyl)-2,3-dihydroindole-1,5-dicarboxylic acid 1-methyl ester
SpectraBase Compound ID 3iklaIMs8G
InChI InChI=1S/C22H22N2O5/c1-14(19(25)23-16-7-5-4-6-8-16)12-22(2)13-24(21(28)29-3)18-10-9-15(20(26)27)11-17(18)22/h4-11H,1,12-13H2,2-3H3,(H,23,25)(H,26,27)
InChIKey BHESERIDCRKLHA-UHFFFAOYSA-N
Mol Weight 394.43 g/mol
Molecular Formula C22H22N2O5
Exact Mass 394.152872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IYy2Myp6cJn
Name 3-Methyl-3-(2-phenylcarbamoylallyl)-2,3-dihydroindole-1,5-dicarboxylic acid 1-methyl ester
Alternate Name(s) 3-[2-(anilinocarbonyl)-2-propenyl]-1-(methoxycarbonyl)-3-methyl-5-indolinecarboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22N2O5
InChI InChI=1S/C22H22N2O5/c1-14(19(25)23-16-7-5-4-6-8-16)12-22(2)13-24(21(28)29-3)18-10-9-15(20(26)27)11-17(18)22/h4-11H,1,12-13H2,2-3H3,(H,23,25)(H,26,27)
InChIKey BHESERIDCRKLHA-UHFFFAOYSA-N
Molecular Weight 394.427 g/mol
SMILES OC(c1cc2c(N(CC2(CC(C(Nc2ccccc2)=O)=C)C)C(=O)OC)cc1)=O
SPLASH splash10-01q9-0940000000-cc74b923d4c36f905ae1
Source of Spectrum F-57-10343-11
Wiley ID 1626833