| SpectraBase Compound ID | 12wGmjQYb4T |
|---|---|
| InChI | InChI=1S/C11H12O/c1-10(2)11(12-10)7-8-5-3-4-6-9(8)11/h3-6H,7H2,1-2H3 |
| InChIKey | KXLAMZMRKKAUTK-UHFFFAOYSA-N |
| Mol Weight | 160.22 g/mol |
| Molecular Formula | C11H12O |
| Exact Mass | 160.088815 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | LcEhbBFAE71 |
|---|---|
| Name | 1,1'-Epoxy-1-(1'-methylethylidene)-benzocyclobutene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 160.088815005 u |
| Formula | C11H12O |
| InChI | InChI=1S/C11H12O/c1-10(2)11(12-10)7-8-5-3-4-6-9(8)11/h3-6H,7H2,1-2H3 |
| InChIKey | KXLAMZMRKKAUTK-UHFFFAOYSA-N |
| Molecular Weight | 160.216 g/mol |
| SMILES | C12(OC2(C)C)C2=CC=CC=C2C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.874907 |