| SpectraBase Compound ID | H5zaraDg2vW |
|---|---|
| InChI | InChI=1S/C18H20ClN5O5/c1-8-2-3-10(26)9(4-8)5-20-15-12-16(23-18(19)22-15)24(7-21-12)17-14(28)13(27)11(6-25)29-17/h2-4,7,11,13-14,17,25-28H,5-6H2,1H3,(H,20,22,23)/t11-,13-,14-,17-/m0/s1 |
| InChIKey | ZWAREHVKERVEOT-MJFSBKNWSA-N |
| Mol Weight | 421.84 g/mol |
| Molecular Formula | C18H20ClN5O5 |
| Exact Mass | 421.115296 g/mol |
15N Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HC8mGIqvKJp |
|---|---|
| Name | 2-CHLORO-N6-(2-HYDROXY-5-METHYLBENZYL)-ADENOSINE |
| Compound Number | L13 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C18H20ClN5O5 |
| InChI | InChI=1S/C18H20ClN5O5/c1-8-2-3-10(26)9(4-8)5-20-15-12-16(23-18(19)22-15)24(7-21-12)17-14(28)13(27)11(6-25)29-17/h2-4,7,11,13-14,17,25-28H,5-6H2,1H3,(H,20,22,23)/t11-,13-,14-,17-/m0/s1 |
| InChIKey | ZWAREHVKERVEOT-MJFSBKNWSA-N |
| Literature Reference Author | P.STARHA,I.POPA,Z.TRAVNICEK,J.VANCO |
| Literature Reference Citation | MOLECULES,18,6990(2013) |
| Literature Reference DOI | 10.3390/molecules18066990 |
| Solvent | DMF-D7 |
| Source File Reference | UWBT9460 |