![Bicyclo[2.2.1]hept-5-en-2-one, 6-chloro-](/api/spectrum/LGpzssvyi5s/structure.png?h=300&w=458 "Bicyclo[2.2.1]hept-5-en-2-one, 6-chloro-")
| SpectraBase Compound ID | HaRcZBIJ2Hi |
|---|---|
| InChI | InChI=1S/C7H7ClO/c8-6-2-4-1-5(6)7(9)3-4/h2,4-5H,1,3H2/t4-,5+/m0/s1 |
| InChIKey | PQEZIURYRQBDRG-CRCLSJGQSA-N |
| Mol Weight | 142.58 g/mol |
| Molecular Formula | C7H7ClO |
| Exact Mass | 142.018543 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | LGpzssvyi5s |
|---|---|
| Name | Bicyclo[2.2.1]hept-5-en-2-one, 6-chloro- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 142.018542544 u |
| Formula | C7H7ClO |
| InChI | InChI=1S/C7H7ClO/c8-6-2-4-1-5(6)7(9)3-4/h2,4-5H,1,3H2/t4-,5+/m0/s1 |
| InChIKey | PQEZIURYRQBDRG-CRCLSJGQSA-N |
| Molecular Weight | 142.585 g/mol |
| SMILES | [C@]12(C(=C[C@](C2)(CC1=O)[H])Cl)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.948153 |