| SpectraBase Compound ID | EkcoqP9ljJ3 |
|---|---|
| InChI | InChI=1S/C46H80N2O13/c1-29(2)26-38(52)59-44-33(6)57-39(28-46(44,7)54)60-42-32(5)58-45(41(53)40(42)48(8)9)61-43-34(22-24-47-23-16-11-12-17-25-49)27-30(3)35(50)19-15-13-14-18-31(4)56-37(51)21-20-36(43)55-10/h13-15,19-21,29-36,39-45,47,49-50,53-54H,11-12,16-18,22-28H2,1-10H3/b14-13+,19-15+,21-20+/t30-,31-,32-,33+,34+,35+,36+,39+,40-,41-,42-,43+,44+,45+,46-/m1/s1 |
| InChIKey | LVVUIMRDJZXKOG-ZGKSOOAXSA-N |
| Mol Weight | 869.1 g/mol |
| Molecular Formula | C46H80N2O13 |
| Exact Mass | 868.566041 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 8lQS2HmkXin |
|---|---|
| Name | LVVUIMRDJZXKOG-ZGKSOOAXSA-N |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H80N2O13 |
| InChI | InChI=1S/C46H80N2O13/c1-29(2)26-38(52)59-44-33(6)57-39(28-46(44,7)54)60-42-32(5)58-45(41(53)40(42)48(8)9)61-43-34(22-24-47-23-16-11-12-17-25-49)27-30(3)35(50)19-15-13-14-18-31(4)56-37(51)21-20-36(43)55-10/h13-15,19-21,29-36,39-45,47,49-50,53-54H,11-12,16-18,22-28H2,1-10H3/b14-13+,19-15+,21-20+/t30-,31-,32-,33+,34+,35+,36+,39+,40-,41-,42-,43+,44+,45+,46-/m1/s1 |
| InChIKey | LVVUIMRDJZXKOG-ZGKSOOAXSA-N |
| Literature Reference Author | P.PRZYBYLSKI,K.PYTA,J.STEFANSKA,B.BRZEZINSKI,F.BARTL |
| Literature Reference Citation | MAGN.RES.CHEM.,48,286(2010) |
| Literature Reference DOI | 10.1002/mrc.2574 |
| Molecular Weight | 869.147 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWIR16530 |