![3-[(6,7,8-trimethoxy-4-quinazolinyl)amino]-1,2-propanediol, dinitrate (ester), maleate(1:1)](/api/spectrum/KGRhdVNf1r/structure.png?h=300&w=458 "3-[(6,7,8-trimethoxy-4-quinazolinyl)amino]-1,2-propanediol, dinitrate (ester), maleate(1:1)")
| SpectraBase Compound ID | LFsN916TEIR |
|---|---|
| InChI | InChI=1S/C14H17N5O9.C4H4O4/c1-24-10-4-9-11(13(26-3)12(10)25-2)16-7-17-14(9)15-5-8(28-19(22)23)6-27-18(20)21;5-3(6)1-2-4(7)8/h4,7-8H,5-6H2,1-3H3,(H,15,16,17);1-2H,(H,5,6)(H,7,8)/b;2-1- |
| InChIKey | XSBMXIUSLRDCPX-BTJKTKAUSA-N |
| Mol Weight | 515.39 g/mol |
| Molecular Formula | C18H21N5O13 |
| Exact Mass | 515.113586 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | KGRhdVNf1r |
|---|---|
| Name | 3-[(6,7,8-trimethoxy-4-quinazolinyl)amino]-1,2-propanediol, dinitrate (ester), maleate(1:1) |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H21N5O13 |
| InChI | InChI=1S/C14H17N5O9.C4H4O4/c1-24-10-4-9-11(13(26-3)12(10)25-2)16-7-17-14(9)15-5-8(28-19(22)23)6-27-18(20)21;5-3(6)1-2-4(7)8/h4,7-8H,5-6H2,1-3H3,(H,15,16,17);1-2H,(H,5,6)(H,7,8)/b;2-1- |
| InChIKey | XSBMXIUSLRDCPX-BTJKTKAUSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 59691M |
| Solvent | DMSO-d6 |