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N-Benzyl-N-[3-(3-cyanophenyl)-1,1-dimethylprop-2-ynyl]malonamic acid ethyl ester
SpectraBase Compound ID E6AcXW15SvQ
InChI InChI=1S/C24H24N2O3/c1-4-29-23(28)16-22(27)26(18-20-9-6-5-7-10-20)24(2,3)14-13-19-11-8-12-21(15-19)17-25/h5-12,15H,4,16,18H2,1-3H3
InChIKey YLBXOBFFFMVBAC-UHFFFAOYSA-N
Mol Weight 388.47 g/mol
Molecular Formula C24H24N2O3
Exact Mass 388.178693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BedLqDXKU6F
Name N-Benzyl-N-[3-(3-cyanophenyl)-1,1-dimethylprop-2-ynyl]malonamic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H24N2O3
InChI InChI=1S/C24H24N2O3/c1-4-29-23(28)16-22(27)26(18-20-9-6-5-7-10-20)24(2,3)14-13-19-11-8-12-21(15-19)17-25/h5-12,15H,4,16,18H2,1-3H3
InChIKey YLBXOBFFFMVBAC-UHFFFAOYSA-N
Molecular Weight 388.467 g/mol
SMILES C(CC(=O)N(C(C#Cc1cc(ccc1)C#N)(C)C)Cc1ccccc1)(=O)OCC
SPLASH splash10-000f-9005000000-64bf9d9597cf664a140b
Source of Spectrum F4-0-2026-4
Synonyms Ethyl 3-{benzyl[3-(3-cyanophenyl)-1,1-dimethyl-2-propynyl]amino}-3-oxopropanoate
Wiley ID 1619941