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2',3'-O-(3-Carboxy-1-methyl-propylidene)-N/6/-(3-methyl-2-butenyl)-adenosine
SpectraBase Compound ID EdOLsroo5lc
InChI InChI=1S/C20H27N5O6/c1-11(2)5-7-21-17-14-18(23-9-22-17)25(10-24-14)19-16-15(12(8-26)29-19)30-20(3,31-16)6-4-13(27)28/h5,9-10,12,15-16,19,26H,4,6-8H2,1-3H3,(H,27,28)(H,21,22,23)
InChIKey WDQJPBQAAOMEIC-UHFFFAOYSA-N
Mol Weight 433.47 g/mol
Molecular Formula C20H27N5O6
Exact Mass 433.196134 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4XwiABCGm7a
Name 2',3'-O-(3-Carboxy-1-methyl-propylidene)-N/6/-(3-methyl-2-butenyl)-adenosine
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Formula C20H27N5O6
InChI InChI=1S/C20H27N5O6/c1-11(2)5-7-21-17-14-18(23-9-22-17)25(10-24-14)19-16-15(12(8-26)29-19)30-20(3,31-16)6-4-13(27)28/h5,9-10,12,15-16,19,26H,4,6-8H2,1-3H3,(H,27,28)(H,21,22,23)
InChIKey WDQJPBQAAOMEIC-UHFFFAOYSA-N
Literature Reference H. Rosemeyer, F. Seela, Angew. Chem. 96, 365 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6