| SpectraBase Compound ID | 4j1EGnmW9qH |
|---|---|
| InChI | InChI=1S/C27H50N2O3Si2/c1-9-10-14-17-23(31-33(3,4)5)19-20-25-24(18-15-12-11-13-16-21-28)26(29-30-2)22-27(25)32-34(6,7)8/h12,15,19-20,23-25,27H,9-11,13-14,16-18,22H2,1-8H3/b15-12+,20-19+,29-26- |
| InChIKey | AXHYVOHTCIQMCS-RASKUKKVSA-N |
| Mol Weight | 506.9 g/mol |
| Molecular Formula | C27H50N2O3Si2 |
| Exact Mass | 506.335997 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5X5uL5nHKNn |
|---|---|
| Name | 9-oxo-11,15-Dihydroxyprosta-5,13-dienenitrile bis(tms) ether methoxime minor isomer |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 506.335996545 u |
| Formula | C27H50N2O3Si2 |
| InChI | InChI=1S/C27H50N2O3Si2/c1-9-10-14-17-23(31-33(3,4)5)19-20-25-24(18-15-12-11-13-16-21-28)26(29-30-2)22-27(25)32-34(6,7)8/h12,15,19-20,23-25,27H,9-11,13-14,16-18,22H2,1-8H3/b15-12+,20-19+,29-26- |
| InChIKey | AXHYVOHTCIQMCS-RASKUKKVSA-N |
| Molecular Weight | 506.878 g/mol |
| SMILES | C1(C(C\C(C1C\C=C\CCCC#N)=N\OC)O[Si](C)(C)C)\C=C\C(CCCCC)O[Si](C)(C)C |