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9-[[2-(BENZYLOXYMETHYL)-3,3-DIFLUOROCYCLOPROPENYL]-METHYL]-ADENINE
SpectraBase Compound ID 9ZQWGeDczlo
InChI InChI=1S/C17H15F2N5O/c18-17(19)12(13(17)8-25-7-11-4-2-1-3-5-11)6-24-10-23-14-15(20)21-9-22-16(14)24/h1-5,9-10H,6-8H2,(H2,20,21,22)
InChIKey SLWITBBOBLZJMN-UHFFFAOYSA-N
Mol Weight 343.34 g/mol
Molecular Formula C17H15F2N5O
Exact Mass 343.124466 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KRI0WdHjsxk
Name 9-[[2-(BENZYLOXYMETHYL)-3,3-DIFLUOROCYCLOPROPENYL]-METHYL]-ADENINE
Compound Number 13A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H15F2N5O
InChI InChI=1S/C17H15F2N5O/c18-17(19)12(13(17)8-25-7-11-4-2-1-3-5-11)6-24-10-23-14-15(20)21-9-22-16(14)24/h1-5,9-10H,6-8H2,(H2,20,21,22)
InChIKey SLWITBBOBLZJMN-UHFFFAOYSA-N
Literature Reference Author R.WANG,M.B.KSEBATI,T.H.CORBETT,E.R.KERN,J.C.DRACH,J.ZEMLICKA
Literature Reference Citation J.MED.CHEM.,44,4019(2001)
Literature Reference DOI 10.1021/jm010191w
Molecular Weight 343.336 g/mol
Sample ID 45139
Solvent DMSO-D6