| SpectraBase Compound ID | HqCB5sYY3dR |
|---|---|
| InChI | InChI=1S/C6H12O/c1-5-3-7-4-6(5)2/h5-6H,3-4H2,1-2H3/t5-,6-/m0/s1 |
| InChIKey | FVAHHPPJYLVIIC-WDSKDSINSA-N |
| Mol Weight | 100.16 g/mol |
| Molecular Formula | C6H12O |
| Exact Mass | 100.088815 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 | AUHRtFzFb0S |
|---|---|
| Name | Trans-3,4-dimethyltetrahydrofuran |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 100.088815005 u |
| Formula | C6H12O |
| InChI | InChI=1S/C6H12O/c1-5-3-7-4-6(5)2/h5-6H,3-4H2,1-2H3/t5-,6-/m0/s1 |
| InChIKey | FVAHHPPJYLVIIC-WDSKDSINSA-N |
| Molecular Weight | 100.161 g/mol |
| SMILES | [C@@]1([H])(C)COC[C@]1([H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.956011 |