| SpectraBase Compound ID | 2fplXrVJy59 |
|---|---|
| InChI | InChI=1S/C13H19FO3/c14-11-5-7-13(8-6-11)17-10-12(16)4-2-1-3-9-15/h5-8,12,15-16H,1-4,9-10H2/t12-/m0/s1 |
| InChIKey | KJNCFGAYUMXQBE-LBPRGKRZSA-N |
| Mol Weight | 242.29 g/mol |
| Molecular Formula | C13H19FO3 |
| Exact Mass | 242.131823 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LOmEklOWdwR |
|---|---|
| Name | (6S)-7-(4-Fluorophenoxy)heptane-1,6-diol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H19FO3 |
| InChI | InChI=1S/C13H19FO3/c14-11-5-7-13(8-6-11)17-10-12(16)4-2-1-3-9-15/h5-8,12,15-16H,1-4,9-10H2/t12-/m0/s1 |
| InChIKey | KJNCFGAYUMXQBE-LBPRGKRZSA-N |
| Molecular Weight | 242.290 g/mol |
| SMILES | O[C@@](CCCCCO)(COc1ccc(cc1)F)[H] |
| SPLASH | splash10-03dl-8900000000-6ff92f708b29f02c4a6e |
| Source of Spectrum | KD-16-937-6 |
| Wiley ID | 1637551 |