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

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2,6-DI-tert-BUTYL-4-[(E)-2-DIETHYL-AMINO-VINYL]-5-ETHYL-PYRIMIDINE-1H+,3H+-DIIUM-BIS-(TRIFLUORO-METHANE-SULFONATE)
SpectraBase Compound ID 5XKJvYDph4k
InChI InChI=1S/C20H35N3.2CHF3O3S/c1-10-15-16(13-14-23(11-2)12-3)21-18(20(7,8)9)22-17(15)19(4,5)6;2*2-1(3,4)8(5,6)7/h13-14H,10-12H2,1-9H3;2*(H,5,6,7)
InChIKey QFDRKRRTGSHGSK-UHFFFAOYSA-N
Mol Weight 617.66 g/mol
Molecular Formula C22H37F6N3O6S2
Exact Mass 617.202797 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IXMXwlBqFxY
Name 2,6-DI-tert-BUTYL-4-[(E)-2-DIETHYL-AMINO-VINYL]-5-ETHYL-PYRIMIDINE-1H+,3H+-DIIUM-BIS-(TRIFLUORO-METHANE-SULFONATE)
Compound Number 4C
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C20H35N3.2CHF3O3S/c1-10-15-16(13-14-23(11-2)12-3)21-18(20(7,8)9)22-17(15)19(4,5)6;2*2-1(3,4)8(5,6)7/h13-14H,10-12H2,1-9H3;2*(H,5,6,7)
InChIKey QFDRKRRTGSHGSK-UHFFFAOYSA-N
Literature Reference R.RAHM,G.MAAS J.HETCYCL.CHEM.,33,439(1996)
Solvent Acetonitrile-d3