| SpectraBase Compound ID | DArxp2LFM8R |
|---|---|
| InChI | InChI=1S/C9H18O/c1-6-9(4,5)7(2)8(3)10/h6-8,10H,1H2,2-5H3 |
| InChIKey | AKIXGLGODKNDPD-UHFFFAOYSA-N |
| Mol Weight | 142.24 g/mol |
| Molecular Formula | C9H18O |
| Exact Mass | 142.135765 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 | 61fNRYKkdlR |
|---|---|
| Name | 3,4,4-Trimethyl-5-hexen-2-ol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 142.135765199 u |
| Formula | C9H18O |
| InChI | InChI=1S/C9H18O/c1-6-9(4,5)7(2)8(3)10/h6-8,10H,1H2,2-5H3 |
| InChIKey | AKIXGLGODKNDPD-UHFFFAOYSA-N |
| Molecular Weight | 142.242 g/mol |
| SMILES | C(C(C(O)C)C)(C=C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.949068 |