| SpectraBase Compound ID | 2vBvJBmYgvQ |
|---|---|
| InChI | InChI=1S/C63H53N5O8/c1-30(69)76-59-56-50-27-48(44-23-40-36-21-38(42(40)25-46(44)50)34-13-7-5-11-32(34)36)54(56)58(55-49-28-51(57(55)59)47-26-43-39-22-37(41(43)24-45(47)49)33-12-6-8-14-35(33)39)74-20-19-73-18-17-65-60(70)52-15-16-53(66-52)61(71)67-62(64)68-63(72)75-29-31-9-3-2-4-10-31/h2-16,23-26,36-39,48-51,66H,17-22,27-29H2,1H3,(H,65,70)(H3,64,67,68,71,72)/t36-,37+,38+,39-,48-,49+,50+,51- |
| InChIKey | IXRAHVJDDIJYMX-OIALEJFKSA-N |
| Mol Weight | 1008.1 g/mol |
| Molecular Formula | C63H53N5O8 |
| Exact Mass | 1007.389414 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 | 83eYraT9a8V |
|---|---|
| Name | IXRAHVJDDIJYMX-OIALEJFKSA-N |
| Compound Number | 11A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C63H53N5O8 |
| InChI | InChI=1S/C63H53N5O8/c1-30(69)76-59-56-50-27-48(44-23-40-36-21-38(42(40)25-46(44)50)34-13-7-5-11-32(34)36)54(56)58(55-49-28-51(57(55)59)47-26-43-39-22-37(41(43)24-45(47)49)33-12-6-8-14-35(33)39)74-20-19-73-18-17-65-60(70)52-15-16-53(66-52)61(71)67-62(64)68-63(72)75-29-31-9-3-2-4-10-31/h2-16,23-26,36-39,48-51,66H,17-22,27-29H2,1H3,(H,65,70)(H3,64,67,68,71,72)/t36-,37+,38+,39-,48-,49+,50+,51- |
| InChIKey | IXRAHVJDDIJYMX-OIALEJFKSA-N |
| Literature Reference Author | T.GERSTHAGEN,J.HOFMANN,F.G.KLAERNER,C.SCHMUCK,T.SCHRADER |
| Literature Reference Citation | EUR.J.ORG.CHEM.,2013,1080(2013) |
| Literature Reference DOI | 10.1002/ejoc.201201052 |
| Molecular Weight | 1008.143 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWBT20605 |