![Cyclobuta[1,2:3,4]dicyclopentene, 1,3a,3b,6,6a,6b-hexahydro-](/api/spectrum/Laeny1sCbe3/structure.png?h=300&w=458 "Cyclobuta[1,2:3,4]dicyclopentene, 1,3a,3b,6,6a,6b-hexahydro-")
| SpectraBase Compound ID | 3kkw2HiGTPt |
|---|---|
| InChI | InChI=1S/C10H12/c1-3-7-8(4-1)10-6-2-5-9(7)10/h1-3,5,7-10H,4,6H2 |
| InChIKey | PTFKYADBCJFBQS-UHFFFAOYSA-N |
| Mol Weight | 132.21 g/mol |
| Molecular Formula | C10H12 |
| Exact Mass | 132.0939 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Laeny1sCbe3 |
|---|---|
| Name | Cyclobuta[1,2:3,4]dicyclopentene, 1,3A,3B,6,6A,6B-hexahydro- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 132.093900386 u |
| Formula | C10H12 |
| InChI | InChI=1S/C10H12/c1-3-7-8(4-1)10-6-2-5-9(7)10/h1-3,5,7-10H,4,6H2 |
| InChIKey | PTFKYADBCJFBQS-UHFFFAOYSA-N |
| Molecular Weight | 132.206 g/mol |
| SMILES | C1C2C(C=C1)C1C2CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.881722 |