| SpectraBase Compound ID | 90lCQTumtR6 |
|---|---|
| InChI | InChI=1S/C8H16O2/c1-3-4-8(10)6-5-7(8,2)9/h9-10H,3-6H2,1-2H3/t7-,8+/m0/s1 |
| InChIKey | AEAXJRKEYZJRJS-JGVFFNPUSA-N |
| Mol Weight | 144.21 g/mol |
| Molecular Formula | C8H16O2 |
| Exact Mass | 144.11503 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | IHdFLHRADvZ |
|---|---|
| Name | 1-Methyl-2-propylcyclobutane-cis-1,2-diol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 144.115029753 u |
| Formula | C8H16O2 |
| InChI | InChI=1S/C8H16O2/c1-3-4-8(10)6-5-7(8,2)9/h9-10H,3-6H2,1-2H3/t7-,8+/m0/s1 |
| InChIKey | AEAXJRKEYZJRJS-JGVFFNPUSA-N |
| Molecular Weight | 144.214 g/mol |
| SMILES | [C@@]1([C@@](O)(CCC)CC1)(O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.88017 |