| SpectraBase Compound ID | 4RrGHqanKeq |
|---|---|
| InChI | InChI=1S/C53H45N5O9Se/c1-32-48(61)58-45-27-15-13-25-41(45)53(50(58)57(32)52(64)66-29-33-16-4-2-5-17-33)28-43(49(62)67-53)55-46(59)39-24-12-14-26-42(39)54-47(60)44(31-68-34-18-6-3-7-19-34)56-51(63)65-30-40-37-22-10-8-20-35(37)36-21-9-11-23-38(36)40/h2-27,32,40,43-44,50H,28-31H2,1H3,(H,54,60)(H,55,59)(H,56,63)/t32-,43+,44-,50-,53-/m0/s1 |
| InChIKey | GTTLSFMJAFJUBT-CWOKBJCNSA-N |
| Mol Weight | 974.9 g/mol |
| Molecular Formula | C53H45N5O9Se |
| Exact Mass | 975.23825 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 | DXFXAto9sg8 |
|---|---|
| Name | GTTLSFMJAFJUBT-CWOKBJCNSA-N |
| Compound Number | 56 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C53H45N5O9Se |
| InChI | InChI=1S/C53H45N5O9Se/c1-32-48(61)58-45-27-15-13-25-41(45)53(50(58)57(32)52(64)66-29-33-16-4-2-5-17-33)28-43(49(62)67-53)55-46(59)39-24-12-14-26-42(39)54-47(60)44(31-68-34-18-6-3-7-19-34)56-51(63)65-30-40-37-22-10-8-20-35(37)36-21-9-11-23-38(36)40/h2-27,32,40,43-44,50H,28-31H2,1H3,(H,54,60)(H,55,59)(H,56,63)/t32-,43+,44-,50-,53-/m0/s1 |
| InChIKey | GTTLSFMJAFJUBT-CWOKBJCNSA-N |
| Literature Reference Author | B.B.SNIDER,H.ZENG |
| Literature Reference Citation | J.ORG.CHEM.,68,545(2003) |
| Literature Reference DOI | 10.1021/jo0264980 |
| Molecular Weight | 974.928 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN25436 |