| SpectraBase Compound ID | HAmyp4tED2b |
|---|---|
| InChI | InChI=1S/C13H17BrN5O7P/c1-13(2)25-7-5(3-23-27(20,21)22)24-11(8(7)26-13)19-10-6(18-12(19)14)9(15)16-4-17-10/h4-5,7-8,11H,3H2,1-2H3,(H2,15,16,17)(H2,20,21,22)/t5-,7-,8-,11-/m0/s1 |
| InChIKey | DTYKZLYFPIJTHN-RYVZHVEOSA-N |
| Mol Weight | 466.18 g/mol |
| Molecular Formula | C13H17BrN5O7P |
| Exact Mass | 465.004898 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6LalEN8KeMa |
|---|---|
| Name | 2',3'-ISOPROPYLIDENE-C8-BROMO-ADENOSINE-5'-MONOPHOSPHATE;BR-AMP-AC |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C13H15BrN5O7P |
| InChI | InChI=1S/C13H17BrN5O7P/c1-13(2)25-7-5(3-23-27(20,21)22)24-11(8(7)26-13)19-10-6(18-12(19)14)9(15)16-4-17-10/h4-5,7-8,11H,3H2,1-2H3,(H2,15,16,17)(H2,20,21,22)/t5-,7-,8-,11-/m0/s1 |
| InChIKey | DTYKZLYFPIJTHN-RYVZHVEOSA-N |
| Literature Reference Author | L.SCHMITT,R.TAMPE |
| Literature Reference Citation | J.AM.CHEM.SOC.,118,5532(1996) |
| Literature Reference DOI | 10.1021/ja953937m |
| Solvent | D2O |
| Source File Reference | UWLU55005 |