| SpectraBase Compound ID | LhdvdDQSBIj |
|---|---|
| InChI | InChI=1S/C23H25N5O9S/c1-12-5-7-16(8-6-12)38(32,33)27-21-18-22(25-10-24-21)28(11-26-18)23-20(36-15(4)31)19(35-14(3)30)17(37-23)9-34-13(2)29/h5-8,10-11,17,19-20,23H,9H2,1-4H3,(H,24,25,27)/t17-,19-,20-,23-/m1/s1 |
| InChIKey | OLTHIZNPCNKARD-ZDXOVATRSA-N |
| Mol Weight | 547.54 g/mol |
| Molecular Formula | C23H25N5O9S |
| Exact Mass | 547.137299 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | rZ65N4LgVz |
|---|---|
| Name | 9-(2,3,5-tri-O-acetyl-.beta.-D-ribofuranosyl)-N6-(p-toluenesulfonyl)adenine |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H25N5O9S |
| InChI | InChI=1S/C23H25N5O9S/c1-12-5-7-16(8-6-12)38(32,33)27-21-18-22(25-10-24-21)28(11-26-18)23-20(36-15(4)31)19(35-14(3)30)17(37-23)9-34-13(2)29/h5-8,10-11,17,19-20,23H,9H2,1-4H3,(H,24,25,27)/t17-,19-,20-,23-/m1/s1 |
| InChIKey | OLTHIZNPCNKARD-ZDXOVATRSA-N |
| Instrument Name | Finnigan 2001 DD |
| Ionization Type | EI |
| Literature Reference DOI | 10.1002/rcm.930 |
| Molecular Weight | 547.539 g/mol |
| SMILES | N(S(=O)(=O)c1ccc(C)cc1)c1c2nc[n](c2ncn1)[C@]1([C@@]([C@@]([C@](O1)(COC(=O)C)[H])(OC(=O)C)[H])(OC(=O)C)[H])[H] |
| SPLASH | splash10-0002-0160190000-449abcb6f954931ef1d7 |
| Source of Spectrum | RCM-17-381-4 |
| Wiley ID | 1836325 |