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N-Benzyl-N-(1,1-dimethyl-3-pyridin-3-ylprop-2-ynyl)malonamic acid ethyl ester
SpectraBase Compound ID 21S8Tw1L1Bt
InChI InChI=1S/C22H24N2O3/c1-4-27-21(26)15-20(25)24(17-19-9-6-5-7-10-19)22(2,3)13-12-18-11-8-14-23-16-18/h5-11,14,16H,4,15,17H2,1-3H3
InChIKey BCLPURVUVIFHIE-UHFFFAOYSA-N
Mol Weight 364.45 g/mol
Molecular Formula C22H24N2O3
Exact Mass 364.178693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3GH0Tb5ETil
Name N-Benzyl-N-(1,1-dimethyl-3-pyridin-3-ylprop-2-ynyl)malonamic acid ethyl ester
Alternate Name(s) Ethyl 3-{benzyl[1,1-dimethyl-3-(3-pyridinyl)-2-propynyl]amino}-3-oxopropanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24N2O3
InChI InChI=1S/C22H24N2O3/c1-4-27-21(26)15-20(25)24(17-19-9-6-5-7-10-19)22(2,3)13-12-18-11-8-14-23-16-18/h5-11,14,16H,4,15,17H2,1-3H3
InChIKey BCLPURVUVIFHIE-UHFFFAOYSA-N
Molecular Weight 364.445 g/mol
SMILES C(CC(=O)N(C(C#Cc1cnccc1)(C)C)Cc1ccccc1)(=O)OCC
SPLASH splash10-000i-0090000000-4e63ff3a6e5696b3412f
Source of Spectrum F4-0-2026-4
Wiley ID 1619940