| SpectraBase Compound ID | 6O7GchOTGbN |
|---|---|
| InChI | InChI=1S/C23H40O3Si/c1-17-10-11-18-20(2,3)12-9-13-22(18,5)23(17)15-14-21(4,26-23)16-19(24)25-27(6,7)8/h10,18H,9,11-16H2,1-8H3/t18-,21-,22-,23+/m0/s1 |
| InChIKey | IKCRCJIEKBYRAH-FDTGPBLFSA-N |
| Mol Weight | 392.7 g/mol |
| Molecular Formula | C23H40O3Si |
| Exact Mass | 392.274672 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AFVYXCQQo1b |
|---|---|
| Name | Grindelic acid, tms |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 392.274671680 u |
| Formula | C23H40O3Si |
| InChI | InChI=1S/C23H40O3Si/c1-17-10-11-18-20(2,3)12-9-13-22(18,5)23(17)15-14-21(4,26-23)16-19(24)25-27(6,7)8/h10,18H,9,11-16H2,1-8H3/t18-,21-,22-,23+/m0/s1 |
| InChIKey | IKCRCJIEKBYRAH-FDTGPBLFSA-N |
| Molecular Weight | 392.655 g/mol |
| SMILES | [C@]12(O[C@@](CC2)(CC(O[Si](C)(C)C)=O)C)C(=CC[C@@]2([C@]1(C)CCCC2(C)C)[H])C |