| SpectraBase Compound ID | GPEB0ZQAVSE |
|---|---|
| InChI | InChI=1S/C12H16O/c1-3-7-10(4-2)11-8-5-6-9-12(11)13/h3,5-6,8-10,13H,1,4,7H2,2H3 |
| InChIKey | WPSBTTLRZHCBCK-UHFFFAOYSA-N |
| Mol Weight | 176.26 g/mol |
| Molecular Formula | C12H16O |
| Exact Mass | 176.120115 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | BRcPDHbur3z |
|---|---|
| Name | 2-(1-Ethylbut-3-enyl)phenol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 176.120115134 u |
| Formula | C12H16O |
| InChI | InChI=1S/C12H16O/c1-3-7-10(4-2)11-8-5-6-9-12(11)13/h3,5-6,8-10,13H,1,4,7H2,2H3 |
| InChIKey | WPSBTTLRZHCBCK-UHFFFAOYSA-N |
| Molecular Weight | 176.259 g/mol |
| SMILES | C=1(C(O)=CC=CC1)C(CC=C)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.925415 |