| SpectraBase Compound ID | GBU1s8nGVgF |
|---|---|
| InChI | InChI=1S/C12H18O2/c1-4-5-8-14-12-9-10(2)6-7-11(12)13-3/h6-7,9H,4-5,8H2,1-3H3 |
| InChIKey | WIKDJNLVXWFPDS-UHFFFAOYSA-N |
| Mol Weight | 194.27 g/mol |
| Molecular Formula | C12H18O2 |
| Exact Mass | 194.13068 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6xbFOZMsQvU |
|---|---|
| Name | 2-Methoxy-5-methylphenol, butyl ether |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.130679818 u |
| Formula | C12H18O2 |
| InChI | InChI=1S/C12H18O2/c1-4-5-8-14-12-9-10(2)6-7-11(12)13-3/h6-7,9H,4-5,8H2,1-3H3 |
| InChIKey | WIKDJNLVXWFPDS-UHFFFAOYSA-N |
| Molecular Weight | 194.274 g/mol |
| SMILES | C1(=C(C=CC(=C1)C)OC)OCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.978393 |