| SpectraBase Compound ID | 7n9pgpbpCRi |
|---|---|
| InChI | InChI=1S/C21H28N4O10/c1-10-5-24(20(30)22-18(10)28)16-3-12(27)15(35-16)8-32-9-33-13-4-17(34-14(13)7-26)25-6-11(2)19(29)23-21(25)31/h5-6,12-17,26-27H,3-4,7-9H2,1-2H3,(H,22,28,30)(H,23,29,31)/t12-,13-,14+,15+,16+,17+/m1/s1 |
| InChIKey | XYPFIEBNCKGKIL-XDKXFUCDSA-N |
| Mol Weight | 496.47 g/mol |
| Molecular Formula | C21H28N4O10 |
| Exact Mass | 496.180543 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | An565MYGTSb |
|---|---|
| Name | XYPFIEBNCKGKIL-XDKXFUCDSA-N |
| Compound Number | 13 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H28N4O10 |
| InChI | InChI=1S/C21H28N4O10/c1-10-5-24(20(30)22-18(10)28)16-3-12(27)15(35-16)8-32-9-33-13-4-17(34-14(13)7-26)25-6-11(2)19(29)23-21(25)31/h5-6,12-17,26-27H,3-4,7-9H2,1-2H3,(H,22,28,30)(H,23,29,31)/t12-,13-,14+,15+,16+,17+/m1/s1 |
| InChIKey | XYPFIEBNCKGKIL-XDKXFUCDSA-N |
| Literature Reference Author | G.H.VEENEMAN,G.A.VANDERMAREL,H.VANDENELST,J.H.VANBOOM |
| Literature Reference Citation | REC.TR.CH.P.-B.,109,449(1990) |
| Molecular Weight | 496.474 g/mol |
| Solvent | Unknown |
| Source File Reference | UWTS2388 |