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3-[2,4-dichloro-5-[[diethoxyphosphoryl(p-tolyl)methyl]amino]phenyl]-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione
SpectraBase Compound ID 313rI7Lms2z
InChI InChI=1S/C24H25Cl2F3N3O5P/c1-5-36-38(35,37-6-2)22(15-9-7-14(3)8-10-15)30-18-12-19(17(26)11-16(18)25)32-21(33)13-20(24(27,28)29)31(4)23(32)34/h7-13,22,30H,5-6H2,1-4H3
InChIKey MKTAYDFVWODAKM-UHFFFAOYSA-N
Mol Weight 594.35 g/mol
Molecular Formula C24H25Cl2F3N3O5P
Exact Mass 593.086098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CW9dXyksUTQ
Name 3-[2,4-dichloro-5-[[diethoxyphosphoryl(p-tolyl)methyl]amino]phenyl]-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H25Cl2F3N3O5P
InChI InChI=1S/C24H25Cl2F3N3O5P/c1-5-36-38(35,37-6-2)22(15-9-7-14(3)8-10-15)30-18-12-19(17(26)11-16(18)25)32-21(33)13-20(24(27,28)29)31(4)23(32)34/h7-13,22,30H,5-6H2,1-4H3
InChIKey MKTAYDFVWODAKM-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 594.355 g/mol
SMILES N(c1cc(N2C(N(C(=CC2=O)C(F)(F)F)C)=O)c(cc1Cl)Cl)C(P(OCC)(=O)OCC)c1ccc(cc1)C
SPLASH splash10-0a4i-0000900000-0a57fbd5e78dff77c5bb
Source of Spectrum CN105218582A
Wiley ID 1850767