| SpectraBase Compound ID | HTxeQBmVNEP |
|---|---|
| InChI | InChI=1S/C11H16O2/c1-8-4-5-10(9(2)7-12)6-11(8)13-3/h4-6,9,12H,7H2,1-3H3 |
| InChIKey | FYBQFZVCPHEDDM-UHFFFAOYSA-N |
| Mol Weight | 180.25 g/mol |
| Molecular Formula | C11H16O2 |
| Exact Mass | 180.11503 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | J4QLnUc94KU |
|---|---|
| Name | 2-(3-Methoxy-4-methyl-phenyl)-propan-1-ol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 180.115029753 u |
| Formula | C11H16O2 |
| InChI | InChI=1S/C11H16O2/c1-8-4-5-10(9(2)7-12)6-11(8)13-3/h4-6,9,12H,7H2,1-3H3 |
| InChIKey | FYBQFZVCPHEDDM-UHFFFAOYSA-N |
| Molecular Weight | 180.247 g/mol |
| SMILES | C=1C(=CC=C(C1OC)C)C(CO)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.955355 |