| SpectraBase Compound ID | BqfeXxxhrcC |
|---|---|
| InChI | InChI=1S/C12H14O2/c1-10-6-3-4-7-12(10)8-5-9-14-11(2)13/h3-8H,9H2,1-2H3/b8-5+ |
| InChIKey | QTGPEDFMTKVXBA-VMPITWQZSA-N |
| Mol Weight | 190.24 g/mol |
| Molecular Formula | C12H14O2 |
| Exact Mass | 190.09938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BZXn1wMxOiF |
|---|---|
| Name | 2-Propen-1-ol, 3-(2-methylphenyl)-, acetate, (E)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 190.099379689 u |
| Formula | C12H14O2 |
| InChI | InChI=1S/C12H14O2/c1-10-6-3-4-7-12(10)8-5-9-14-11(2)13/h3-8H,9H2,1-2H3/b8-5+ |
| InChIKey | QTGPEDFMTKVXBA-VMPITWQZSA-N |
| Molecular Weight | 190.242 g/mol |
| SMILES | C1(=C(C=CC=C1)\C=C\COC(C)=O)C |