| SpectraBase Compound ID | 5a5KdJmWfn0 |
|---|---|
| InChI | InChI=1S/C13H14N4O6/c1-2-7(18)22-3-6-9(19)10(20)13(23-6)17-5-16-8-11(17)14-4-15-12(8)21/h2,4-6,9-10,13,19-20H,1,3H2,(H,14,15,21)/t6-,9-,10-,13-/m0/s1 |
| InChIKey | RYPKSVDZQUAJAC-VHMYRRENSA-N |
| Mol Weight | 322.28 g/mol |
| Molecular Formula | C13H14N4O6 |
| Exact Mass | 322.091334 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CrqeGopPjaA |
|---|---|
| Name | RYPKSVDZQUAJAC-VHMYRRENSA-N |
| Compound Number | 7I |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C13H14N4O6 |
| InChI | InChI=1S/C13H14N4O6/c1-2-7(18)22-3-6-9(19)10(20)13(23-6)17-5-16-8-11(17)14-4-15-12(8)21/h2,4-6,9-10,13,19-20H,1,3H2,(H,14,15,21)/t6-,9-,10-,13-/m0/s1 |
| InChIKey | RYPKSVDZQUAJAC-VHMYRRENSA-N |
| Literature Reference Author | F.MORIS,V.GOTOR |
| Literature Reference Citation | J.ORG.CHEM.,58,653(1993) |
| Literature Reference DOI | 10.1021/jo00055a018 |
| Molecular Weight | 322.277 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWCS18859 |