| SpectraBase Compound ID | CFaNBkMDZSi |
|---|---|
| InChI | InChI=1S/C11H14N6O7/c12-11-13-8(22)3-4(9(23)14-11)17(16-15-3)10-7(21)6(20)5(19)2(1-18)24-10/h2,5-7,10,18-21H,1H2,(H3,12,13,14,22,23)/t2-,5-,6+,7-,10-/m0/s1 |
| InChIKey | TYXQUFMEMZRXQZ-KDHVEQDOSA-N |
| Mol Weight | 342.27 g/mol |
| Molecular Formula | C11H14N6O7 |
| Exact Mass | 342.092397 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3QPA1Amv8wQ |
|---|---|
| Name | TYXQUFMEMZRXQZ-KDHVEQDOSA-N |
| Compound Number | 19 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C11H14N6O7 |
| InChI | InChI=1S/C11H14N6O7/c12-11-13-8(22)3-4(9(23)14-11)17(16-15-3)10-7(21)6(20)5(19)2(1-18)24-10/h2,5-7,10,18-21H,1H2,(H3,12,13,14,22,23)/t2-,5-,6+,7-,10-/m0/s1 |
| InChIKey | TYXQUFMEMZRXQZ-KDHVEQDOSA-N |
| Literature Reference Author | Y.A.AL-SOUD,N.A.AL-MASOUDI |
| Literature Reference Citation | SPECTROSC.LETT.,36,461(2003) |
| Literature Reference DOI | 10.1081/sl-120026612 |
| Molecular Weight | 342.268 g/mol |
| Sample ID | 968983 |
| Solvent | DMSO-D6 |