| SpectraBase Compound ID | 9xXH4RPFAZ8 |
|---|---|
| InChI | InChI=1S/C6H6/c1-3-5-6-4-2/h1,4-6H,2H2/b6-5+/i1D |
| InChIKey | OGWJYLKDZYZYBA-KTQYUCJBSA-N |
| Mol Weight | 79.12 g/mol |
| Molecular Formula | C6H5D |
| Exact Mass | 79.053227 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3PkgUEXe2ml |
|---|---|
| Name | 6-Deuterio-1,3-hexadien-5-yne |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H5D |
| InChI | InChI=1S/C6H6/c1-3-5-6-4-2/h1,4-6H,2H2/b6-5+/i1D |
| InChIKey | OGWJYLKDZYZYBA-KTQYUCJBSA-N |
| Molecular Weight | 79.120 g/mol |
| SMILES | C=C\C=C\C#C[D] |
| SPLASH | splash10-004i-9000000000-fbbe5c1caf13a6236264 |
| Source of Spectrum | U-1997-1512-1 |
| Wiley ID | 769974 |