| SpectraBase Compound ID | 1PYCevkezeo |
|---|---|
| InChI | InChI=1S/C20H32O4Si/c1-5-6-7-8-9-10-13-16-23-19(21)17-14-11-12-15-18(17)20(22)24-25(2,3)4/h11-12,14-15H,5-10,13,16H2,1-4H3 |
| InChIKey | VEIZOZWVWJFZHN-UHFFFAOYSA-N |
| Mol Weight | 364.6 g/mol |
| Molecular Formula | C20H32O4Si |
| Exact Mass | 364.206986 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JmsIXLJ1J9w |
|---|---|
| Name | Monononyl phthalate, tms derivative |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 364.206986041 u |
| Formula | C20H32O4Si |
| InChI | InChI=1S/C20H32O4Si/c1-5-6-7-8-9-10-13-16-23-19(21)17-14-11-12-15-18(17)20(22)24-25(2,3)4/h11-12,14-15H,5-10,13,16H2,1-4H3 |
| InChIKey | VEIZOZWVWJFZHN-UHFFFAOYSA-N |
| Molecular Weight | 364.557 g/mol |
| SMILES | C1=CC=CC(=C1C(=O)OCCCCCCCCC)C(=O)O[Si](C)(C)C |