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Ethyl 2-acetylamino-2-cyano-3-(4-nitrophenyl)-5-oxo-5-(4-methylphenyl)pentanoate
SpectraBase Compound ID 6frEZT0v2nN
InChI InChI=1S/C23H23N3O6/c1-4-32-22(29)23(14-24,25-16(3)27)20(17-9-11-19(12-10-17)26(30)31)13-21(28)18-7-5-15(2)6-8-18/h5-12,20H,4,13H2,1-3H3,(H,25,27)
InChIKey LMSQSRASLNWCOB-UHFFFAOYSA-N
Mol Weight 437.45 g/mol
Molecular Formula C23H23N3O6
Exact Mass 437.158685 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9XrVzXrQXcx
Name Ethyl 2-acetylamino-2-cyano-3-(4-nitrophenyl)-5-oxo-5-(4-methylphenyl)pentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H23N3O6
InChI InChI=1S/C23H23N3O6/c1-4-32-22(29)23(14-24,25-16(3)27)20(17-9-11-19(12-10-17)26(30)31)13-21(28)18-7-5-15(2)6-8-18/h5-12,20H,4,13H2,1-3H3,(H,25,27)
InChIKey LMSQSRASLNWCOB-UHFFFAOYSA-N
Molecular Weight 437.452 g/mol
SMILES N(C(C(=O)OCC)(C(CC(c1ccc(cc1)C)=O)c1ccc(cc1)N(=O)=O)C#N)C(=O)C
SPLASH splash10-00kf-9050000000-5dd852d783e3a8b04ca8
Source of Spectrum CV-2004-1024-6
Synonyms Ethyl 2-(acetylamino)-2-cyano-5-(4-methylphenyl)-3-(4-nitrophenyl)-5-oxopentanoate
Wiley ID 1611270