| SpectraBase Compound ID | 3YyMIApt7Xa |
|---|---|
| InChI | InChI=1S/2C13H22N2O7S/c2*1-11(20,6-16)8(17)13-10(19)14-12(21,9(18)15-13)7(5-23-2)3-4-22-13/h2*7-8,16-17,20-21H,3-6H2,1-2H3,(H,14,19)(H,15,18)/t2*7?,8?,11?,12-,13+/m11/s1 |
| InChIKey | OHIYNKJALDGIRF-BNDCDPFWSA-N |
| Mol Weight | 700.77 g/mol |
| Molecular Formula | C26H44N4O14S2 |
| Exact Mass | 700.229544 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1LtKwJc6ER6 |
|---|---|
| Name | OHIYNKJALDGIRF-BNDCDPFWSA-N |
| Compound Number | 14A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H44N4O14S2 |
| InChI | InChI=1S/2C13H22N2O7S/c2*1-11(20,6-16)8(17)13-10(19)14-12(21,9(18)15-13)7(5-23-2)3-4-22-13/h2*7-8,16-17,20-21H,3-6H2,1-2H3,(H,14,19)(H,15,18)/t2*7?,8?,11?,12-,13+/m11/s1 |
| InChIKey | OHIYNKJALDGIRF-BNDCDPFWSA-N |
| Literature Reference Author | S.ABUZAR,H.KOHN |
| Literature Reference Citation | J.AM.CHEM.SOC.,112,3114(1990) |
| Literature Reference DOI | 10.1021/ja00164a036 |
| Molecular Weight | 700.774 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWRU6593 |