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4-[(E)-2-DIETHYL-AMINO-VINYL]-5-ETHYL-2,6-DIMETHYL-PYRIMIDINE-1H+,3H+-DIIUM-BIS-(TRIFLUORO-METHANE-SULFONATE)

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4-[(E)-2-DIETHYL-AMINO-VINYL]-5-ETHYL-2,6-DIMETHYL-PYRIMIDINE-1H+,3H+-DIIUM-BIS-(TRIFLUORO-METHANE-SULFONATE)
SpectraBase Compound ID A0EVhTLe5ts
InChI InChI=1S/C14H23N3.2CHF3O3S/c1-6-13-11(4)15-12(5)16-14(13)9-10-17(7-2)8-3;2*2-1(3,4)8(5,6)7/h9-10H,6-8H2,1-5H3;2*(H,5,6,7)
InChIKey BQCRDLTVBHTRHO-UHFFFAOYSA-N
Mol Weight 533.5 g/mol
Molecular Formula C16H25F6N3O6S2
Exact Mass 533.108897 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AbrUCvLl72e
Name 4-[(E)-2-DIETHYL-AMINO-VINYL]-5-ETHYL-2,6-DIMETHYL-PYRIMIDINE-1H+,3H+-DIIUM-BIS-(TRIFLUORO-METHANE-SULFONATE)
Compound Number 4A
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C14H23N3.2CHF3O3S/c1-6-13-11(4)15-12(5)16-14(13)9-10-17(7-2)8-3;2*2-1(3,4)8(5,6)7/h9-10H,6-8H2,1-5H3;2*(H,5,6,7)
InChIKey BQCRDLTVBHTRHO-UHFFFAOYSA-N
Literature Reference R.RAHM,G.MAAS J.HETCYCL.CHEM.,33,439(1996)
Solvent Acetonitrile-d3:Chloroform-d=1:1