| SpectraBase Compound ID | FcFxAbBJmWi |
|---|---|
| InChI | InChI=1S/C43H33O5P.Na/c1-47-42-38-34-16-36(32-14-28-24-10-22(26(28)12-30(32)34)18-6-2-4-8-20(18)24)40(38)43(48-49(44,45)46)41-37-17-35(39(41)42)31-13-27-23-11-25(29(27)15-33(31)37)21-9-5-3-7-19(21)23;/h2-9,12-15,22-25,34-37H,10-11,16-17H2,1H3,(H2,44,45,46);/q;+2/p-2/t22-,23+,24+,25-,34-,35+,36+,37-; |
| InChIKey | NYUARODXHNBREV-NWNNXORZSA-L |
| Mol Weight | 681.7 g/mol |
| Molecular Formula | C43H31NaO5P |
| Exact Mass | 681.18068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5TX2dn4Wvs |
|---|---|
| Name | NYUARODXHNBREV-NWNNXORZSA-L |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H31NaO5P |
| InChI | InChI=1S/C43H33O5P.Na/c1-47-42-38-34-16-36(32-14-28-24-10-22(26(28)12-30(32)34)18-6-2-4-8-20(18)24)40(38)43(48-49(44,45)46)41-37-17-35(39(41)42)31-13-27-23-11-25(29(27)15-33(31)37)21-9-5-3-7-19(21)23;/h2-9,12-15,22-25,34-37H,10-11,16-17H2,1H3,(H2,44,45,46);/q;+2/p-2/t22-,23+,24+,25-,34-,35+,36+,37-; |
| InChIKey | NYUARODXHNBREV-NWNNXORZSA-L |
| Literature Reference Author | S.DUTT,C.WILCH,T.GERSTHAGEN,C.WOELPER,A.A.SOWISLOK,F.G.KLAER NER,T.SCHRADER |
| Literature Reference Citation | EUR.J.ORG.CHEM.,2013,7705(2013) |
| Literature Reference DOI | 10.1002/ejoc.201301211 |
| Molecular Weight | 681.680 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWBT20433 |