| SpectraBase Compound ID | LyUhs4BLUN5 |
|---|---|
| InChI | InChI=1S/C13H26O2Si/c1-11(2)8-7-9-12(3)10-13(14)15-16(4,5)6/h8,12H,7,9-10H2,1-6H3 |
| InChIKey | NVBOIUPUPKAOBL-UHFFFAOYSA-N |
| Mol Weight | 242.43 g/mol |
| Molecular Formula | C13H26O2Si |
| Exact Mass | 242.170207 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LY3oZTZqBgH |
|---|---|
| Name | (S)-(-)-citronellic acid, tms derivative |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 242.170206610 u |
| Formula | C13H26O2Si |
| InChI | InChI=1S/C13H26O2Si/c1-11(2)8-7-9-12(3)10-13(14)15-16(4,5)6/h8,12H,7,9-10H2,1-6H3 |
| InChIKey | NVBOIUPUPKAOBL-UHFFFAOYSA-N |
| Molecular Weight | 242.434 g/mol |
| SMILES | C(=CCCC(C)CC(=O)O[Si](C)(C)C)(C)C |