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#55;(R)-6-[6-[[(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-HEPTADECAFLUORODECYL)-DIISOPROPYLSILYLOXY]-METHYL]-1,2,5,6-TETRAHYDROPYRIDIN-3-YL]-3,4-DIHYDRO-1H-AZEPIN-2
SpectraBase Compound ID 5OoP1Y7kjs9
InChI InChI=1S/C28H35F17N2O2Si/c1-15(2)50(16(3)4,49-14-19-9-8-18(12-46-19)17-6-5-7-20(48)47-13-17)11-10-21(29,30)22(31,32)23(33,34)24(35,36)25(37,38)26(39,40)27(41,42)28(43,44)45/h6,8,15-16,19,46H,5,7,9-14H2,1-4H3,(H,47,48)/t19-/m1/s1
InChIKey DSDQKRANOZJXIT-LJQANCHMSA-N
Mol Weight 782.7 g/mol
Molecular Formula C28H35F17N2O2Si
Exact Mass 782.219634 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FqpbyvkAVhH
Name #55;(R)-6-[6-[[(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-HEPTADECAFLUORODECYL)-DIISOPROPYLSILYLOXY]-METHYL]-1,2,5,6-TETRAHYDROPYRIDIN-3-YL]-3,4-DIHYDRO-1H-AZEPIN-2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H35F17N2O2Si
InChI InChI=1S/C28H35F17N2O2Si/c1-15(2)50(16(3)4,49-14-19-9-8-18(12-46-19)17-6-5-7-20(48)47-13-17)11-10-21(29,30)22(31,32)23(33,34)24(35,36)25(37,38)26(39,40)27(41,42)28(43,44)45/h6,8,15-16,19,46H,5,7,9-14H2,1-4H3,(H,47,48)/t19-/m1/s1
InChIKey DSDQKRANOZJXIT-LJQANCHMSA-N
Literature Reference Author S.K.MAURYA,M.DOW,S.WARRINER,A.NELSON
Literature Reference Citation BEIL.J.ORG.CHEM.,9,775(2013)
Literature Reference DOI 10.3762/bjoc.9.88
Molecular Weight 782.656 g/mol
Solvent CDCl3
Source File Reference UWLU77358