| SpectraBase Compound ID | 7f7NzWKaT40 |
|---|---|
| InChI | InChI=1S/C18H28O4Si/c1-13(2)12-21-16(19)14-10-8-9-11-15(14)17(20)22-23(6,7)18(3,4)5/h8-11,13H,12H2,1-7H3 |
| InChIKey | UZCDBADPVOQFRQ-UHFFFAOYSA-N |
| Mol Weight | 336.5 g/mol |
| Molecular Formula | C18H28O4Si |
| Exact Mass | 336.175686 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CsQkWPghi8I |
|---|---|
| Name | Monoisobutyl phthalate, tbdms derivative |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 336.175685913 u |
| Formula | C18H28O4Si |
| InChI | InChI=1S/C18H28O4Si/c1-13(2)12-21-16(19)14-10-8-9-11-15(14)17(20)22-23(6,7)18(3,4)5/h8-11,13H,12H2,1-7H3 |
| InChIKey | UZCDBADPVOQFRQ-UHFFFAOYSA-N |
| Molecular Weight | 336.503 g/mol |
| SMILES | C1=CC(=C(C=C1)C(=O)OCC(C)C)C(=O)O[Si](C)(C(C)(C)C)C |