| SpectraBase Compound ID | 2nNPone2X7K |
|---|---|
| InChI | InChI=1S/C14H14/c1-2-10-14(12-7-4-8-12)13(9-1)11-5-3-6-11/h1-2,5,7,9-10H,3-4,6,8H2 |
| InChIKey | FVGLKWBQEKWWSC-UHFFFAOYSA-N |
| Mol Weight | 182.27 g/mol |
| Molecular Formula | C14H14 |
| Exact Mass | 182.10955 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4sZIeqC34js |
|---|---|
| Name | 1,2-di(1-Cyclobutenyl)benzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 182.109550451 u |
| Formula | C14H14 |
| InChI | InChI=1S/C14H14/c1-2-10-14(12-7-4-8-12)13(9-1)11-5-3-6-11/h1-2,5,7,9-10H,3-4,6,8H2 |
| InChIKey | FVGLKWBQEKWWSC-UHFFFAOYSA-N |
| Molecular Weight | 182.266 g/mol |
| SMILES | C=1(C(C2=CCC2)=CC=CC1)C1=CCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.946446 |