| SpectraBase Compound ID | 9A0vFit1EGi |
|---|---|
| InChI | InChI=1S/C7H12O/c1-3-5-7(4-2)6-8-7/h3H,1,4-6H2,2H3 |
| InChIKey | NNIFVRBSLBRFDB-UHFFFAOYSA-N |
| Mol Weight | 112.17 g/mol |
| Molecular Formula | C7H12O |
| Exact Mass | 112.088815 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 | 6w5yMYvzceo |
|---|---|
| Name | 2-Allyl-2-ethyloxirane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 112.088815005 u |
| Formula | C7H12O |
| InChI | InChI=1S/C7H12O/c1-3-5-7(4-2)6-8-7/h3H,1,4-6H2,2H3 |
| InChIKey | NNIFVRBSLBRFDB-UHFFFAOYSA-N |
| Molecular Weight | 112.172 g/mol |
| SMILES | C1(OC1)(CC)CC=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.953487 |