| SpectraBase Compound ID | CFq6cYInBZJ |
|---|---|
| InChI | InChI=1S/C12H20/c1-11(2,3)9-7-8-10-12(4,5)6/h7,9H,1-6H3/b9-7+ |
| InChIKey | SJKGMWBQDQMRKQ-VQHVLOKHSA-N |
| Mol Weight | 164.29 g/mol |
| Molecular Formula | C12H20 |
| Exact Mass | 164.156501 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2W6xkyuBlrL |
|---|---|
| Name | 1,4-bis(t-Butyl)but-1-en-3-yne |
| CAS Registry Number | 55976-12-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H20 |
| InChI | InChI=1S/C12H20/c1-11(2,3)9-7-8-10-12(4,5)6/h7,9H,1-6H3/b9-7+ |
| InChIKey | SJKGMWBQDQMRKQ-VQHVLOKHSA-N |
| Molecular Weight | 164.292 g/mol |
| SMILES | CC(C)(C)\C=C\C#CC(C)(C)C |
| SPLASH | splash10-0006-9500000000-d48adf5d86d712cc8c63 |
| Source of Spectrum | EP-2781-0-0 |
| Synonyms | 3-Octen-5-yne, 2,2,7,7-tetramethyl-, (E)- 3-Octen-5-yne, 2,2,7,7-tetramethyl- (3E)-2,2,7,7-Tetramethyl-3-octen-5-yne Dimer of Butylacetylene (E)-2,2,7,7-tetramethyloct-3-en-5-yne 2,2,7,7-Tetramethyloct-3-en-5-yne |
| Wiley ID | 1161044 |