![Bicyclo[4.2.0]octa-1,3,5-triene (monodeuterated)](/api/spectrum/BfqRX6ar6Fi/structure.png?h=300&w=458 "Bicyclo[4.2.0]octa-1,3,5-triene (monodeuterated)")
| SpectraBase Compound ID | 90hsvDLzK1d |
|---|---|
| InChI | InChI=1S/C8H8/c1-2-4-8-6-5-7(8)3-1/h1-4H,5-6H2/i5D |
| InChIKey | UMIVXZPTRXBADB-UICOGKGYSA-N |
| Mol Weight | 105.16 g/mol |
| Molecular Formula | C8H7D |
| Exact Mass | 105.068877 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BfqRX6ar6Fi |
|---|---|
| Name | Bicyclo[4.2.0]octa-1,3,5-triene (monodeuterated) |
| CAS Registry Number | 31458-01-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H7D |
| InChI | InChI=1S/C8H8/c1-2-4-8-6-5-7(8)3-1/h1-4H,5-6H2/i5D |
| InChIKey | UMIVXZPTRXBADB-UICOGKGYSA-N |
| Molecular Weight | 105.158 g/mol |
| SMILES | c1c2c(ccc1)C([D])C2 |
| SPLASH | splash10-0pb9-6900000000-5b63d08a2175ce672d19 |
| Wiley ID | 1493192 |