| SpectraBase Compound ID | 31IX367DXxx |
|---|---|
| InChI | InChI=1S/C13H18N2O7/c1-2-3-9(17)21-6-7-10(18)11(19)12(22-7)15-5-4-8(16)14-13(15)20/h4-5,7,10-12,18-19H,2-3,6H2,1H3,(H,14,16,20)/t7-,10-,11-,12-/m0/s1 |
| InChIKey | TYXCUKNZAWEEGG-BVALORAHSA-N |
| Mol Weight | 314.29 g/mol |
| Molecular Formula | C13H18N2O7 |
| Exact Mass | 314.111401 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CR1lV6pXVnS |
|---|---|
| Name | TYXCUKNZAWEEGG-BVALORAHSA-N |
| Compound Number | 7B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C13H18N2O7 |
| InChI | InChI=1S/C13H18N2O7/c1-2-3-9(17)21-6-7-10(18)11(19)12(22-7)15-5-4-8(16)14-13(15)20/h4-5,7,10-12,18-19H,2-3,6H2,1H3,(H,14,16,20)/t7-,10-,11-,12-/m0/s1 |
| InChIKey | TYXCUKNZAWEEGG-BVALORAHSA-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 | 314.295 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWCS18852 |