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3-BETA-[6-(DIBENZOYLAMINO)-9H-PURIN-9-YL]-ALPHA-[(METHOXYTRITYLOXY)-METHYL]-CYCLOBUTANE-1-BETA-METHANOL
SpectraBase Compound ID DwSsZsoEpQk
InChI InChI=1S/C45H39N5O5/c1-54-38-24-22-36(23-25-38)45(34-18-10-4-11-19-34,35-20-12-5-13-21-35)55-29-44(28-51)26-37(27-44)49-31-48-39-40(49)46-30-47-41(39)50(42(52)32-14-6-2-7-15-32)43(53)33-16-8-3-9-17-33/h2-25,30-31,37,51H,26-29H2,1H3/t37-,44-
InChIKey QSMXWAUSVKHVGN-RGTFAYNKSA-N
Mol Weight 729.8 g/mol
Molecular Formula C45H39N5O5
Exact Mass 729.295119 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GnlIqb3knSS
Name 3-BETA-[6-(DIBENZOYLAMINO)-9H-PURIN-9-YL]-ALPHA-[(METHOXYTRITYLOXY)-METHYL]-CYCLOBUTANE-1-BETA-METHANOL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C45H39N5O5
InChI InChI=1S/C45H39N5O5/c1-54-38-24-22-36(23-25-38)45(34-18-10-4-11-19-34,35-20-12-5-13-21-35)55-29-44(28-51)26-37(27-44)49-31-48-39-40(49)46-30-47-41(39)50(42(52)32-14-6-2-7-15-32)43(53)33-16-8-3-9-17-33/h2-25,30-31,37,51H,26-29H2,1H3/t37-,44-
InChIKey QSMXWAUSVKHVGN-RGTFAYNKSA-N
Literature Reference Author J.M.HENLIN,H.RINK,E.SPIESER,G.BASCHANG
Literature Reference Citation HELV.CHIM.ACTA,75,589(1992)
Literature Reference DOI 10.1002/hlca.19920750216
Molecular Weight 729.835 g/mol
Solvent CDCl3
Source File Reference UWCS7339