| SpectraBase Compound ID | IIXBNCgjyIX |
|---|---|
| InChI | InChI=1S/C43H64O4/c1-9-38(3)23-17-32-30(26-38)13-15-34-40(5,19-11-21-42(32,34)7)28-46-36(44)25-37(45)47-29-41(6)20-12-22-43(8)33-18-24-39(4,10-2)27-31(33)14-16-35(41)43/h9-10,17-18,30-31,34-35H,1-2,11-16,19-29H2,3-8H3/t30?,31?,34?,35?,38-,39-,40+,41+,42+,43+/m0/s1 |
| InChIKey | JLHZSURRFCCNFM-MFFYFRMKSA-N |
| Mol Weight | 645.0 g/mol |
| Molecular Formula | C43H64O4 |
| Exact Mass | 644.480461 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4zoAVJqe8cr |
|---|---|
| Name | POLIFOSATE |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H64O4 |
| InChI | InChI=1S/C43H64O4/c1-9-38(3)23-17-32-30(26-38)13-15-34-40(5,19-11-21-42(32,34)7)28-46-36(44)25-37(45)47-29-41(6)20-12-22-43(8)33-18-24-39(4,10-2)27-31(33)14-16-35(41)43/h9-10,17-18,30-31,34-35H,1-2,11-16,19-29H2,3-8H3/t30?,31?,34?,35?,38-,39-,40+,41+,42+,43+/m0/s1 |
| InChIKey | JLHZSURRFCCNFM-MFFYFRMKSA-N |
| Literature Reference Author | M.C.CHAMY,M.PIOVANO,J.A.GARBARINO,V.GAMBARO |
| Literature Reference Citation | PHYTOCHEM.,30,3365(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)83211-3 |
| Molecular Weight | 644.979 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI23307 |