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N-(1)-METHYL-N-(2)-(P-ANISYLDIPHENYLMETHYL)-9-[(4-FLUORO)-3-P-ANISYLDIPHENYLMETHOXY-METHYLBUTYL]-GUANINE
SpectraBase Compound ID GZD5fSZnz2o
InChI InChI=1S/C51H48FN5O4/c1-56-48(58)46-47(54-49(56)55-50(38-16-8-4-9-17-38,39-18-10-5-11-19-39)40-24-28-44(59-2)29-25-40)57(36-53-46)33-32-37(34-52)35-61-51(41-20-12-6-13-21-41,42-22-14-7-15-23-42)43-26-30-45(60-3)31-27-43/h4-31,36-37H,32-35H2,1-3H3,(H,54,55)
InChIKey RVEQMYXIRNVOHC-UHFFFAOYSA-N
Mol Weight 814.0 g/mol
Molecular Formula C51H48FN5O4
Exact Mass 813.369033 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1KqQrn7aEin
Name N-(1)-METHYL-N-(2)-(P-ANISYLDIPHENYLMETHYL)-9-[(4-FLUORO)-3-P-ANISYLDIPHENYLMETHOXY-METHYLBUTYL]-GUANINE
Compound Number 34
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C51H48FN5O4
InChI InChI=1S/C51H48FN5O4/c1-56-48(58)46-47(54-49(56)55-50(38-16-8-4-9-17-38,39-18-10-5-11-19-39)40-24-28-44(59-2)29-25-40)57(36-53-46)33-32-37(34-52)35-61-51(41-20-12-6-13-21-41,42-22-14-7-15-23-42)43-26-30-45(60-3)31-27-43/h4-31,36-37H,32-35H2,1-3H3,(H,54,55)
InChIKey RVEQMYXIRNVOHC-UHFFFAOYSA-N
Literature Reference Author M.GROTE,S.NOLL,B.NOLL,B.JOHANNSEN,W.KRAUS
Literature Reference Citation CAN.J.CHEM.,82,513(2004)
Literature Reference DOI 10.1139/v04-005
Solvent DMSO-D6
Source File Reference UWVN27527