| SpectraBase Compound ID | J94tMSX88Yi |
|---|---|
| InChI | InChI=1S/C8H16O/c1-6-4-5-7(2)8(6,3)9/h6-7,9H,4-5H2,1-3H3/t6-,7-/m1/s1 |
| InChIKey | AKMPYCFDXLJQJS-RNFRBKRXSA-N |
| Mol Weight | 128.21 g/mol |
| Molecular Formula | C8H16O |
| Exact Mass | 128.120115 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | BDAoFFKOKLl |
|---|---|
| Name | (1R*,2R*,5R*)-1,2,5-Trimethylcyclopentanol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 128.120115134 u |
| Formula | C8H16O |
| InChI | InChI=1S/C8H16O/c1-6-4-5-7(2)8(6,3)9/h6-7,9H,4-5H2,1-3H3/t6-,7-/m1/s1 |
| InChIKey | AKMPYCFDXLJQJS-RNFRBKRXSA-N |
| Molecular Weight | 128.215 g/mol |
| SMILES | C1([C@@](CC[C@]1(C)[H])(C)[H])(O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.859746 |