| SpectraBase Compound ID | B0vvJhQuZY |
|---|---|
| InChI | InChI=1S/C10H14O/c1-9-4-6-10(7-5-9)3-2-8-11/h4-7,11H,2-3,8H2,1H3 |
| InChIKey | NJIRMTSCELFREO-UHFFFAOYSA-N |
| Mol Weight | 150.22 g/mol |
| Molecular Formula | C10H14O |
| Exact Mass | 150.104465 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EkFB525EgeC |
|---|---|
| Name | Benzenepropanol, 4-methyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 150.104465070 u |
| Formula | C10H14O |
| InChI | InChI=1S/C10H14O/c1-9-4-6-10(7-5-9)3-2-8-11/h4-7,11H,2-3,8H2,1H3 |
| InChIKey | NJIRMTSCELFREO-UHFFFAOYSA-N |
| Molecular Weight | 150.221 g/mol |
| SMILES | C1=C(C=CC(=C1)C)CCCO |