| SpectraBase Compound ID | KtFV8WDcWmZ |
|---|---|
| InChI | InChI=1S/C12H17NO4Si/c1-6-9(12(16)17-18(3,4)5)13-10(14)7-8(2)11(13)15/h6-7H,1-5H3/b9-6- |
| InChIKey | CJGCQXKERLAODD-TWGQIWQCSA-N |
| Mol Weight | 267.36 g/mol |
| Molecular Formula | C12H17NO4Si |
| Exact Mass | 267.092685 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8FCrTODMTGh |
|---|---|
| Name | Pencolide, tms |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 267.092684562 u |
| Formula | C12H17NO4Si |
| InChI | InChI=1S/C12H17NO4Si/c1-6-9(12(16)17-18(3,4)5)13-10(14)7-8(2)11(13)15/h6-7H,1-5H3/b9-6- |
| InChIKey | CJGCQXKERLAODD-TWGQIWQCSA-N |
| Molecular Weight | 267.356 g/mol |
| SMILES | C1(N(C(C=C1C)=O)\C(C(=O)O[Si](C)(C)C)=C\C)=O |