| SpectraBase Compound ID | 9fNjhWN8LKn |
|---|---|
| InChI | InChI=1S/C13H18O2/c1-3-4-12(14)8-5-11-6-9-13(15-2)10-7-11/h3,6-7,9-10,12,14H,1,4-5,8H2,2H3/t12-/m1/s1 |
| InChIKey | LIPUDOPRHVTINZ-GFCCVEGCSA-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 | 1zrMKOHTbaS |
|---|---|
| Name | (+)-(alpha-S)1-(4-methoxy-alpha-prop-2-en-1-yl)benzenepropanol |
| 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/c1-3-4-12(14)8-5-11-6-9-13(15-2)10-7-11/h3,6-7,9-10,12,14H,1,4-5,8H2,2H3/t12-/m1/s1 |
| InChIKey | LIPUDOPRHVTINZ-GFCCVEGCSA-N |
| Molecular Weight | 206.285 g/mol |
| SMILES | C(C1=CC=C(OC)C=C1)C[C@@](CC=C)(O)[H] |