| SpectraBase Compound ID | LBpmPP8CnJo |
|---|---|
| InChI | InChI=1S/C21H33N3O12/c1-7-32-19(29)10(2)23-15(28)8-22-21(30)24-16-18(35-13(5)27)17(34-12(4)26)14(9-33-11(3)25)36-20(16)31-6/h10,14,16-18,20H,7-9H2,1-6H3,(H,23,28)(H2,22,24,30)/t10?,14-,16-,17-,18-,20-/m0/s1 |
| InChIKey | NQWJGGSUHHDMJH-ZZSGMBRZSA-N |
| Mol Weight | 519.5 g/mol |
| Molecular Formula | C21H33N3O12 |
| Exact Mass | 519.206424 g/mol |
15N Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9Xr2CTyEvj4 |
|---|---|
| Name | NQWJGGSUHHDMJH-ZZSGMBRZSA-N |
| Compound Number | 13 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H33N3O12 |
| InChI | InChI=1S/C21H33N3O12/c1-7-32-19(29)10(2)23-15(28)8-22-21(30)24-16-18(35-13(5)27)17(34-12(4)26)14(9-33-11(3)25)36-20(16)31-6/h10,14,16-18,20H,7-9H2,1-6H3,(H,23,28)(H2,22,24,30)/t10?,14-,16-,17-,18-,20-/m0/s1 |
| InChIKey | NQWJGGSUHHDMJH-ZZSGMBRZSA-N |
| Literature Reference Author | M.WEYCHERT,J.KLIMKIEWICZ,I.WAWER,B.PIEKARSKA-BARTOSZEWICZ,A. TEMERIUSZ |
| Literature Reference Citation | MAGN.RES.CHEM.,36,727(1998) |
| Literature Reference DOI | 10.1002/(sici)1097-458x(199810)36:10<727::aid-omr359>3.0.co;2-a |
| Solvent | CDCl3 |
| Source File Reference | UWSI9150 |