| SpectraBase Compound ID | 5cx41EkhcuO |
|---|---|
| InChI | InChI=1S/C11H16O2/c1-8(9(2)12)11(13)10-6-4-3-5-7-10/h3-9,11-13H,1-2H3/t8-,9-,11+/m0/s1 |
| InChIKey | QHXAOJQLZHLLON-ATZCPNFKSA-N |
| Mol Weight | 180.25 g/mol |
| Molecular Formula | C11H16O2 |
| Exact Mass | 180.11503 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9Fbmv6pSXk7 |
|---|---|
| Name | (1R,2S,3S)-2-methyl-1-phenyl-butane-1,3-diol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H16O2 |
| InChI | InChI=1S/C11H16O2/c1-8(9(2)12)11(13)10-6-4-3-5-7-10/h3-9,11-13H,1-2H3/t8-,9-,11+/m0/s1 |
| InChIKey | QHXAOJQLZHLLON-ATZCPNFKSA-N |
| Molecular Weight | 180.247 g/mol |
| SMILES | O[C@]([C@]([C@@](O)(C)[H])(C)[H])(c1ccccc1)[H] |
| SPLASH | splash10-0a4i-0900000000-b648ff7559defbf703db |
| Source of Spectrum | F-70-1288-5 |
| Wiley ID | 1596193 |