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6-((4-methyl-3-(trifluoromethyl)phenyl)((2,2,2',2'-tetramethyl-4,4'-bi(1,3-dioxolan)-5-yl)methyl)amino)pyrimidine-2,4(1H,3H)-dione

View entire compound with spectra: 1 MS (GC)

6-((4-methyl-3-(trifluoromethyl)phenyl)((2,2,2',2'-tetramethyl-4,4'-bi(1,3-dioxolan)-5-yl)methyl)amino)pyrimidine-2,4(1H,3H)-dione
SpectraBase Compound ID 7PxGE1CJmAH
InChI InChI=1S/C23H28F3N3O6/c1-12-6-7-13(8-14(12)23(24,25)26)29(17-9-18(30)28-20(31)27-17)10-15-19(35-22(4,5)33-15)16-11-32-21(2,3)34-16/h6-9,15-16,19H,10-11H2,1-5H3,(H2,27,28,30,31)
InChIKey XSVSTSQGXUADDR-UHFFFAOYSA-N
Mol Weight 499.49 g/mol
Molecular Formula C23H28F3N3O6
Exact Mass 499.19302 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cv6PaZCYgN9
Name 6-((4-methyl-3-(trifluoromethyl)phenyl)((2,2,2',2'-tetramethyl-4,4'-bi(1,3-dioxolan)-5-yl)methyl)amino)pyrimidine-2,4(1H,3H)-dione
Alternate Name(s) 6-((4-methyl-3-(trifluoromethyl)phenyl)((2,2,2',2'-tetramethyl-[4,4'-bi(1,3-dioxolan)]-5-yl)methyl)amino)pyrimidine-2,4(1H,3H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H28F3N3O6
InChI InChI=1S/C23H28F3N3O6/c1-12-6-7-13(8-14(12)23(24,25)26)29(17-9-18(30)28-20(31)27-17)10-15-19(35-22(4,5)33-15)16-11-32-21(2,3)34-16/h6-9,15-16,19H,10-11H2,1-5H3,(H2,27,28,30,31)
InChIKey XSVSTSQGXUADDR-UHFFFAOYSA-N
Molecular Weight 499.487 g/mol
SMILES N1C(NC(N(CC2C(OC(C)(C)O2)C2OC(OC2)(C)C)c2ccc(c(c2)C(F)(F)F)C)=CC1=O)=O
SPLASH splash10-000i-0090200000-a1042167c8533a1b870c
Source of Spectrum CBC-14-652-6b
Wiley ID 1786812