| SpectraBase Compound ID | 2aKZCaHpwyS |
|---|---|
| InChI | InChI=1S/C18H26N4O6/c1-17(2,3)14(24)27-9-21-8-19-12-11(21)13(23)20(7)16(26)22(12)10-28-15(25)18(4,5)6/h8H,9-10H2,1-7H3 |
| InChIKey | BJNKRPNNVTXIDI-UHFFFAOYSA-N |
| Mol Weight | 394.43 g/mol |
| Molecular Formula | C18H26N4O6 |
| Exact Mass | 394.185235 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8ekiZ2httH4 |
|---|---|
| Name | 3,7-bis(hydroxymethyl)-1-methylxanthine, dipivalate (ester) |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H26N4O6 |
| InChI | InChI=1S/C18H26N4O6/c1-17(2,3)14(24)27-9-21-8-19-12-11(21)13(23)20(7)16(26)22(12)10-28-15(25)18(4,5)6/h8H,9-10H2,1-7H3 |
| InChIKey | BJNKRPNNVTXIDI-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 36518M |
| Solvent | CDCl3 |