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9-[(1R,4S)-4-[(1S)-1,2-DIHYDROXYETHYL]-CYCLOBUT-2-EN-1-YL]-METHYL]-GUANINE
SpectraBase Compound ID FntDzF0YqZd
InChI InChI=1S/C12H15N5O3/c13-12-15-10-9(11(20)16-12)14-5-17(10)3-6-1-2-7(6)8(19)4-18/h1-2,5-9,18-19H,3-4H2,(H2,13,16,20)/t6-,7-,8+,9?/m0/s1
InChIKey DDRQTDMRBNVAFS-VTBDLZGYSA-N
Mol Weight 277.28 g/mol
Molecular Formula C12H15N5O3
Exact Mass 277.117489 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7jKipKjbFnf
Name 9-[(1R,4S)-4-[(1S)-1,2-DIHYDROXYETHYL]-CYCLOBUT-2-EN-1-YL]-METHYL]-GUANINE
Compound Number 8-G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H15N5O3
InChI InChI=1S/C12H15N5O3/c13-12-15-10-9(11(20)16-12)14-5-17(10)3-6-1-2-7(6)8(19)4-18/h1-2,5-9,18-19H,3-4H2,(H2,13,16,20)/t6-,7-,8+,9?/m0/s1
InChIKey DDRQTDMRBNVAFS-VTBDLZGYSA-N
Literature Reference Author R.MIRALLES-LLUMA,A.FIGUERAS,F.BUSQUE,A.ALVAREZ-LARENA,J.BALZ ARINI,M.FIGUEREDO,
Literature Reference Citation EUR.J.ORG.CHEM.,2013,7761(2013)
Literature Reference DOI 10.1002/ejoc.201301097
Molecular Weight 277.283 g/mol
Solvent CD3OD
Source File Reference UWBT20207