| SpectraBase Compound ID | 2koWsBEeiT1 |
|---|---|
| InChI | InChI=1S/C41H35N6O5P/c1-4-51-35(48)39-27-38(2,3)52-34(39)40(28-43)29(26-42)25-41(39,47-37(50)45(36(49)46(40)47)30-17-9-5-10-18-30)44-53(31-19-11-6-12-20-31,32-21-13-7-14-22-32)33-23-15-8-16-24-33/h5-25,34H,4,27H2,1-3H3/t34-,39-,40-,41+/m0/s1 |
| InChIKey | INXVDHIONQSVPP-XXDDULSTSA-N |
| Mol Weight | 722.7 g/mol |
| Molecular Formula | C41H35N6O5P |
| Exact Mass | 722.240655 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2sxEBkN8VY3 |
|---|---|
| Name | INXVDHIONQSVPP-XXDDULSTSA-N |
| CAS Registry Number | 115483-81-3 |
| Compound Number | 4B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H35N6O5P |
| InChI | InChI=1S/C41H35N6O5P/c1-4-51-35(48)39-27-38(2,3)52-34(39)40(28-43)29(26-42)25-41(39,47-37(50)45(36(49)46(40)47)30-17-9-5-10-18-30)44-53(31-19-11-6-12-20-31,32-21-13-7-14-22-32)33-23-15-8-16-24-33/h5-25,34H,4,27H2,1-3H3/t34-,39-,40-,41+/m0/s1 |
| InChIKey | INXVDHIONQSVPP-XXDDULSTSA-N |
| Literature Reference Author | H.WAMHOFF,F.J.FASSBENDER,M.NIEGER |
| Literature Reference Citation | CHEM.BER.,121,2157(1988) |
| Literature Reference DOI | 10.1002/cber.19881211214 |
| Molecular Weight | 722.740 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWGB1699 |