| SpectraBase Compound ID | 1lSCrByEHz8 |
|---|---|
| InChI | InChI=1S/C17H21N3O5/c1-10-8-20(16-14(23)13(22)12(9-21)25-16)17(19-15(10)24)18-7-11-5-3-2-4-6-11/h2-6,8,12-14,16,21-23H,7,9H2,1H3,(H,18,19,24)/t12-,13-,14-,16-/m0/s1 |
| InChIKey | WBAIBQFSSNOOPO-YXWQFLTLSA-N |
| Mol Weight | 347.37 g/mol |
| Molecular Formula | C17H21N3O5 |
| Exact Mass | 347.148121 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F3KiK3YBeZ7 |
|---|---|
| Name | N2-BENZYL-5-METHYLISOCYTIDINE |
| Compound Number | 6F |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C17H21N3O5 |
| InChI | InChI=1S/C17H21N3O5/c1-10-8-20(16-14(23)13(22)12(9-21)25-16)17(19-15(10)24)18-7-11-5-3-2-4-6-11/h2-6,8,12-14,16,21-23H,7,9H2,1H3,(H,18,19,24)/t12-,13-,14-,16-/m0/s1 |
| InChIKey | WBAIBQFSSNOOPO-YXWQFLTLSA-N |
| Literature Reference Author | A.A.H.ABDEL-RAHMAN,E.B.PEDERSEN,C.NIELSEN |
| Literature Reference Citation | MH.CHEM.,127,455(1996) |
| Literature Reference DOI | 10.1007/BF00810888 |
| Molecular Weight | 347.371 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWMZ180 |