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2',3'-ISOPROPYLIDENE-C8-(AMINOETHYLAMINO)-ADENOSINE-5'-MONOPHOSPHATE;C8-AE-AMP-AC
SpectraBase Compound ID CWJoOYE3FLR
InChI InChI=1S/C15H24N7O7P/c1-15(2)28-9-7(5-26-30(23,24)25)27-13(10(9)29-15)22-12-8(11(17)19-6-20-12)21-14(22)18-4-3-16/h6-7,9-10,13H,3-5,16H2,1-2H3,(H,18,21)(H2,17,19,20)(H2,23,24,25)/t7-,9-,10-,13-/m0/s1
InChIKey KKVKFXDSCHPUAS-PYSAPBNWSA-N
Mol Weight 445.37 g/mol
Molecular Formula C15H24N7O7P
Exact Mass 445.147483 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 50KT4Rdfo9B
Name 2',3'-ISOPROPYLIDENE-C8-(AMINOETHYLAMINO)-ADENOSINE-5'-MONOPHOSPHATE;C8-AE-AMP-AC
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H23N7O7P
InChI InChI=1S/C15H24N7O7P/c1-15(2)28-9-7(5-26-30(23,24)25)27-13(10(9)29-15)22-12-8(11(17)19-6-20-12)21-14(22)18-4-3-16/h6-7,9-10,13H,3-5,16H2,1-2H3,(H,18,21)(H2,17,19,20)(H2,23,24,25)/t7-,9-,10-,13-/m0/s1
InChIKey KKVKFXDSCHPUAS-PYSAPBNWSA-N
Literature Reference Author L.SCHMITT,R.TAMPE
Literature Reference Citation J.AM.CHEM.SOC.,118,5532(1996)
Literature Reference DOI 10.1021/ja953937m
Molecular Weight 444.364 g/mol
Sample ID 55006
Solvent D2O