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trans-4-AMINO-5-FLUORO-1-[9,10-DIHYDRO-10-(METHANE-SULFONAMIDO)-9-PHENANTHRENYL]-2(3H)-PYRIMIDINONE

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trans-4-AMINO-5-FLUORO-1-[9,10-DIHYDRO-10-(METHANE-SULFONAMIDO)-9-PHENANTHRENYL]-2(3H)-PYRIMIDINONE
SpectraBase Compound ID JvvcSCk9pzE
InChI InChI=1S/C19H17FN4O3S/c1-28(26,27)23-16-13-8-4-2-6-11(13)12-7-3-5-9-14(12)17(16)24-10-15(20)18(21)22-19(24)25/h2-10,16-17,23H,1H3,(H2,21,22,25)/t16-,17-/m1/s1
InChIKey KYKAJVVFJQVQKL-IAGOWNOFSA-N
Mol Weight 400.43 g/mol
Molecular Formula C19H17FN4O3S
Exact Mass 400.10054 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4h7LCS3svmK
Name trans-4-AMINO-5-FLUORO-1-[9,10-DIHYDRO-10-(METHANE-SULFONAMIDO)-9-PHENANTHRENYL]-2(3H)-PYRIMIDINONE
Compound Number 18
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C19H17FN4O3S/c1-28(26,27)23-16-13-8-4-2-6-11(13)12-7-3-5-9-14(12)17(16)24-10-15(20)18(21)22-19(24)25/h2-10,16-17,23H,1H3,(H2,21,22,25)/t16-,17-/m1/s1
InChIKey KYKAJVVFJQVQKL-IAGOWNOFSA-N
Literature Reference J.HETCYCL.CHEM.,33,681(1996) Y.SHALOM,R.G.HARVEY,J.BLUM
Solvent Dimethyl sulfoxide-d6
Technique SELECTIVE DECOUPLING