| SpectraBase Compound ID | 9NnfzaY0y7i |
|---|---|
| InChI | InChI=1S/C42H43N4O9PS/c1-49-34-19-15-32(16-20-34)42(31-13-8-5-9-14-31,33-17-21-35(50-2)22-18-33)52-29-37-36(55-56(3,57)53-26-10-24-43)27-39(54-37)46-25-23-38(44-40(46)47)45-41(48)51-28-30-11-6-4-7-12-30/h4-9,11-23,25,36-37,39H,10,26-29H2,1-3H3,(H,44,45,47,48)/t36-,37+,39+,56?/m1/s1 |
| InChIKey | SOEKGBMKIOPCQE-DSKUSDIJSA-N |
| Mol Weight | 810.9 g/mol |
| Molecular Formula | C42H43N4O9PS |
| Exact Mass | 810.248837 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 24wcBCPDzo9 |
|---|---|
| Name | R=CH2CH2CN) |
| Compound Number | FAST_RP-5-(B=C_BZ |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H43N4O9PS |
| InChI | InChI=1S/C42H43N4O9PS/c1-49-34-19-15-32(16-20-34)42(31-13-8-5-9-14-31,33-17-21-35(50-2)22-18-33)52-29-37-36(55-56(3,57)53-26-10-24-43)27-39(54-37)46-25-23-38(44-40(46)47)45-41(48)51-28-30-11-6-4-7-12-30/h4-9,11-23,25,36-37,39H,10,26-29H2,1-3H3,(H,44,45,47,48)/t36-,37+,39+,56?/m1/s1 |
| InChIKey | SOEKGBMKIOPCQE-DSKUSDIJSA-N |
| Literature Reference Author | L.A.WOZNIAK,A.CHWOROS,J.PYZOWSKI,W.J.STEC |
| Literature Reference Citation | J.ORG.CHEM.,63,9109(1998) |
| Literature Reference DOI | 10.1021/jo981304v |
| Solvent | CDCl3 |
| Source File Reference | UWMZ27135 |