| SpectraBase Compound ID | 4Iyy4rEHSAK |
|---|---|
| InChI | InChI=1S/C9H16O2/c1-8(2,3)5-6-9(4,11)7-10/h10-11H,7H2,1-4H3 |
| InChIKey | IFQKVXBDFXAEGB-UHFFFAOYSA-N |
| Mol Weight | 156.22 g/mol |
| Molecular Formula | C9H16O2 |
| Exact Mass | 156.11503 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FtmPtNBKjma |
|---|---|
| Name | 2,5,5-Trimethylhex-3-yne-1,2-diol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H16O2 |
| InChI | InChI=1S/C9H16O2/c1-8(2,3)5-6-9(4,11)7-10/h10-11H,7H2,1-4H3 |
| InChIKey | IFQKVXBDFXAEGB-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1021/jo301628n |
| Molecular Weight | 156.225 g/mol |
| SMILES | OC(CO)(C#CC(C)(C)C)C |
| SPLASH | splash10-004i-8900000000-5f1aab26e25a617f5578 |
| Source of Spectrum | J-77-8662-1h |
| Wiley ID | 1747053 |