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Butyl 2-anilino-3-(isoquinolin-1'-yl)-3-(methoxycarbonyl)propionate
SpectraBase Compound ID HU4pmqaL7e8
InChI InChI=1S/C24H26N2O4/c1-3-4-16-30-24(28)22(26-18-11-6-5-7-12-18)20(23(27)29-2)21-19-13-9-8-10-17(19)14-15-25-21/h5-15,20,22,26H,3-4,16H2,1-2H3
InChIKey AJBFVGKOQWQVIK-UHFFFAOYSA-N
Mol Weight 406.48 g/mol
Molecular Formula C24H26N2O4
Exact Mass 406.189257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4a4ElgO5yh4
Name Butyl 2-anilino-3-(isoquinolin-1'-yl)-3-(methoxycarbonyl)propionate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H26N2O4
InChI InChI=1S/C24H26N2O4/c1-3-4-16-30-24(28)22(26-18-11-6-5-7-12-18)20(23(27)29-2)21-19-13-9-8-10-17(19)14-15-25-21/h5-15,20,22,26H,3-4,16H2,1-2H3
InChIKey AJBFVGKOQWQVIK-UHFFFAOYSA-N
Molecular Weight 406.482 g/mol
SMILES N(C(C(c1c2c(cccc2)ccn1)C(=O)OC)C(=O)OCCCC)c1ccccc1
SPLASH splash10-0f6x-7941000000-941c129f5961cc554f7a
Source of Spectrum H-83-2378-31
Synonyms 1-Butyl 4-methyl 2-anilino-3-(1-isoquinolinyl)succinate
Wiley ID 847235