| SpectraBase Compound ID | 9esWONAVwph |
|---|---|
| InChI | InChI=1S/2C9H13N3O5.H2O4S/c2*10-5-1-2-12(9(16)11-5)8-7(15)6(14)4(3-13)17-8;1-5(2,3)4/h2*1-2,4,6-8,13-15H,3H2,(H2,10,11,16);(H2,1,2,3,4)/t2*4-,6-,7-,8-;/m11./s1 |
| InChIKey | LXAAYEPISPEVHD-VWDXAFRGSA-N |
| Mol Weight | 584.51 g/mol |
| Molecular Formula | C18H28N6O14S |
| Exact Mass | 584.138421 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3AEuYjrb4nY |
|---|---|
| Name | CYTIDINE, SULFATE (2:1) (SALT) |
| Source of Sample | Fluka AG, Buchs, Switzerland |
| CAS Registry Number | 32747-18-5 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H13N3O5 1/2H2SO4 |
| InChI | InChI=1S/2C9H13N3O5.H2O4S/c2*10-5-1-2-12(9(16)11-5)8-7(15)6(14)4(3-13)17-8;1-5(2,3)4/h2*1-2,4,6-8,13-15H,3H2,(H2,10,11,16);(H2,1,2,3,4)/t2*4-,6-,7-,8-;/m11./s1 |
| InChIKey | LXAAYEPISPEVHD-VWDXAFRGSA-N |
| Melting Point | 230C (dec.) |
| Molecular Weight | 292.26 |
| Solvent | Deuterium oxide/NaOD; Reference=Dioxane Spectrometer= Varian CFT-20 |