| SpectraBase Compound ID | H1Os0t09YYP |
|---|---|
| InChI | InChI=1S/C7H10/c1-2-4-7-5-3-6-7/h2-3,5,7H,1,4,6H2 |
| InChIKey | DEGFQJSJXPQIFO-UHFFFAOYSA-N |
| Mol Weight | 94.16 g/mol |
| Molecular Formula | C7H10 |
| Exact Mass | 94.07825 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 302vy8TTelv |
|---|---|
| Name | 3-Allylcyclobutene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 94.078250322 u |
| Formula | C7H10 |
| InChI | InChI=1S/C7H10/c1-2-4-7-5-3-6-7/h2-3,5,7H,1,4,6H2 |
| InChIKey | DEGFQJSJXPQIFO-UHFFFAOYSA-N |
| Molecular Weight | 94.157 g/mol |
| SMILES | C1=CC(C1)CC=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.96741 |