| SpectraBase Compound ID | 3rooc0V8aAP |
|---|---|
| InChI | InChI=1S/C12H18O2/c1-10(13)8-11(2)14-9-12-6-4-3-5-7-12/h3-7,10-11,13H,8-9H2,1-2H3/t10-,11+/m0/s1 |
| InChIKey | ZDGYZKNTFSWSEU-WDEREUQCSA-N |
| Mol Weight | 194.27 g/mol |
| Molecular Formula | C12H18O2 |
| Exact Mass | 194.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3LF4vjlGgca |
|---|---|
| Name | (2S,4R)-4-(Benzyloxy)pentan-2-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.130679818 u |
| Formula | C12H18O2 |
| InChI | InChI=1S/C12H18O2/c1-10(13)8-11(2)14-9-12-6-4-3-5-7-12/h3-7,10-11,13H,8-9H2,1-2H3/t10-,11+/m0/s1 |
| InChIKey | ZDGYZKNTFSWSEU-WDEREUQCSA-N |
| Molecular Weight | 194.274 g/mol |
| SMILES | C([C@@](C)(OCC1=CC=CC=C1)[H])[C@@](O)(C)[H] |