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Propanamide, N-[1-[2-(3,4-dimethoxyphenyl)ethyl]-2,3,4,5,6,7-hexahydro-2,4,6-trioxo-5-(trifluoromethyl)-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-
SpectraBase Compound ID Dz9rLci4zTZ
InChI InChI=1S/C20H21F3N4O6/c1-4-13(28)26-19(20(21,22)23)14-15(24-17(19)30)27(18(31)25-16(14)29)8-7-10-5-6-11(32-2)12(9-10)33-3/h5-6,9H,4,7-8H2,1-3H3,(H,24,30)(H,26,28)(H,25,29,31)
InChIKey DEVKQXFULQVJCI-UHFFFAOYSA-N
Mol Weight 470.41 g/mol
Molecular Formula C20H21F3N4O6
Exact Mass 470.141319 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CHkQe13OvzS
Name Propanamide, N-[1-[2-(3,4-dimethoxyphenyl)ethyl]-2,3,4,5,6,7-hexahydro-2,4,6-trioxo-5-(trifluoromethyl)-1H-pyrrolo[2,3-d]pyrimidin-5-yl]-
Alternate Name(s) N-[1-[2-(3,4-dimethoxyphenyl)ethyl]-2,4,6-trioxo-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]propanamide N-[1-[2-(3,4-dimethoxyphenyl)ethyl]-2,4,6-tris(oxidanylidene)-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]propanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21F3N4O6
InChI InChI=1S/C20H21F3N4O6/c1-4-13(28)26-19(20(21,22)23)14-15(24-17(19)30)27(18(31)25-16(14)29)8-7-10-5-6-11(32-2)12(9-10)33-3/h5-6,9H,4,7-8H2,1-3H3,(H,24,30)(H,26,28)(H,25,29,31)
InChIKey DEVKQXFULQVJCI-UHFFFAOYSA-N
Molecular Weight 470.405 g/mol
SMILES N1C(C=2C(C(NC2N(C1=O)CCc1cc(c(cc1)OC)OC)=O)(C(F)(F)F)NC(CC)=O)=O
SPLASH splash10-03di-4900000000-c97efad304b1bc35410c
Source of Spectrum IY-1-4601-5
Wiley ID 1653998