| SpectraBase Compound ID | GPv4uJouxwq |
|---|---|
| InChI | InChI=1S/C7H12O/c1-4-6-7(3,8)5-2/h8H,5H2,1-3H3 |
| InChIKey | VLRDHNINMBNPDK-UHFFFAOYSA-N |
| Mol Weight | 112.17 g/mol |
| Molecular Formula | C7H12O |
| Exact Mass | 112.088815 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2rEa2TEJKG4 |
|---|---|
| Name | 3-Methyl-4-hexyn-3-ol |
| CAS Registry Number | 6320-68-9 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O |
| InChI | InChI=1S/C7H12O/c1-4-6-7(3,8)5-2/h8H,5H2,1-3H3 |
| InChIKey | VLRDHNINMBNPDK-UHFFFAOYSA-N |
| Molecular Weight | 112.172 g/mol |
| SMILES | OC(CC)(C#CC)C |
| SPLASH | splash10-001l-9000000000-056dcdff5f88e88eb10d |
| Source of Spectrum | NP-0-3480-0 |
| Wiley ID | 1095422 |