| SpectraBase Compound ID | 6cspASby0lX |
|---|---|
| InChI | InChI=1S/C13H18O2/c1-12(10-14)6-5-9-15-11-13-7-3-2-4-8-13/h2-4,7-8,10,12H,5-6,9,11H2,1H3/t12-/m0/s1 |
| InChIKey | WMGLDZHURAJTMB-LBPRGKRZSA-N |
| Mol Weight | 206.28 g/mol |
| Molecular Formula | C13H18O2 |
| Exact Mass | 206.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K0IGY2u5flg |
|---|---|
| Name | (2S)-5-Benzyloxy-2-methyl-1-pentanal |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 206.130679818 u |
| Formula | C13H18O2 |
| InChI | InChI=1S/C13H18O2/c1-12(10-14)6-5-9-15-11-13-7-3-2-4-8-13/h2-4,7-8,10,12H,5-6,9,11H2,1H3/t12-/m0/s1 |
| InChIKey | WMGLDZHURAJTMB-LBPRGKRZSA-N |
| Molecular Weight | 206.285 g/mol |
| SMILES | C(=O)[C@](CCCOCC=1C=CC=CC1)(C)[H] |