| SpectraBase Compound ID | J9DYERA8i3S |
|---|---|
| InChI | InChI=1S/C29H46O2.3CO.Fe/c1-19(2)8-7-9-20(3)25-12-13-26-24-11-10-22-18-23(31-21(4)30)14-16-28(22,5)27(24)15-17-29(25,26)6;3*1-2;/h10-11,19-20,23,25-27H,7-9,12-18H2,1-6H3;;;;/t20-,23+,25-,26?,27-,28+,29-;;;;/m1..../s1 |
| InChIKey | OMXXOZRDWJNVRJ-USMNPMOYSA-N |
| Mol Weight | 566.6 g/mol |
| Molecular Formula | C32H46FeO5 |
| Exact Mass | 566.269461 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GBkazLHEgfg |
|---|---|
| Name | OMXXOZRDWJNVRJ-USMNPMOYSA-N |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H46FeO5 |
| InChI | InChI=1S/C29H46O2.3CO.Fe/c1-19(2)8-7-9-20(3)25-12-13-26-24-11-10-22-18-23(31-21(4)30)14-16-28(22,5)27(24)15-17-29(25,26)6;3*1-2;/h10-11,19-20,23,25-27H,7-9,12-18H2,1-6H3;;;;/t20-,23+,25-,26?,27-,28+,29-;;;;/m1..../s1 |
| InChIKey | OMXXOZRDWJNVRJ-USMNPMOYSA-N |
| Literature Reference Author | R.E.PERRIER,M.J.MCGLINCHEY |
| Literature Reference Citation | CAN.J.CHEM.,66,3003(1988) |
| Literature Reference DOI | 10.1139/v88-466 |
| Molecular Weight | 566.561 g/mol |
| Solvent | C6D6 |
| Source File Reference | UWCS7934 |