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#71C;(2R,6R)-6-(HYDROXYMETHYL)-N-(PYRIDIN-3-YL)-2-[[(S)-1-(TRIFLUOROMETHYLSULFONYL)-1,2,5,6-TETRAHYDROPYRIDIN-2-YL]-METHYL]-5,6-DIHYDROPYRIDINE-1(2H)-CARBOXAMI

View entire compound with spectra: 1 NMR

#71C;(2R,6R)-6-(HYDROXYMETHYL)-N-(PYRIDIN-3-YL)-2-[[(S)-1-(TRIFLUOROMETHYLSULFONYL)-1,2,5,6-TETRAHYDROPYRIDIN-2-YL]-METHYL]-5,6-DIHYDROPYRIDINE-1(2H)-CARBOXAMI
SpectraBase Compound ID 7vy8kVSElfr
InChI InChI=1S/C19H23F3N4O4S/c20-19(21,22)31(29,30)25-10-2-1-6-15(25)11-16-7-3-8-17(13-27)26(16)18(28)24-14-5-4-9-23-12-14/h1,3-7,9,12,15-17,27H,2,8,10-11,13H2,(H,24,28)/t15-,16+,17-/m1/s1
InChIKey FEEWOAVALVRVBG-IXDOHACOSA-N
Mol Weight 460.47 g/mol
Molecular Formula C19H23F3N4O4S
Exact Mass 460.139211 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4J0em6x82lp
Name #71C;(2R,6R)-6-(HYDROXYMETHYL)-N-(PYRIDIN-3-YL)-2-[[(S)-1-(TRIFLUOROMETHYLSULFONYL)-1,2,5,6-TETRAHYDROPYRIDIN-2-YL]-METHYL]-5,6-DIHYDROPYRIDINE-1(2H)-CARBOXAMI
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H23F3N4O4S
InChI InChI=1S/C19H23F3N4O4S/c20-19(21,22)31(29,30)25-10-2-1-6-15(25)11-16-7-3-8-17(13-27)26(16)18(28)24-14-5-4-9-23-12-14/h1,3-7,9,12,15-17,27H,2,8,10-11,13H2,(H,24,28)/t15-,16+,17-/m1/s1
InChIKey FEEWOAVALVRVBG-IXDOHACOSA-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 460.471 g/mol
Solvent CD3OD
Source File Reference UWLU77395