| SpectraBase Compound ID | C0ly9ySdSEU |
|---|---|
| InChI | InChI=1S/C10H14O/c1-7(2)10-4-3-8(6-11)9(10)5-10/h3,6-7,9H,4-5H2,1-2H3 |
| InChIKey | YZNIFKFTGCAOST-UHFFFAOYSA-N |
| Mol Weight | 150.22 g/mol |
| Molecular Formula | C10H14O |
| Exact Mass | 150.104465 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 | D0SL7vX9dDz |
|---|---|
| Name | .alpha.-Thujenal |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 150.104465070 u |
| Formula | C10H14O |
| InChI | InChI=1S/C10H14O/c1-7(2)10-4-3-8(6-11)9(10)5-10/h3,6-7,9H,4-5H2,1-2H3 |
| InChIKey | YZNIFKFTGCAOST-UHFFFAOYSA-N |
| Molecular Weight | 150.221 g/mol |
| SMILES | C12CC2(CC=C1C=O)C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.890549 |