| SpectraBase Compound ID | Gk74KhOmXIw |
|---|---|
| InChI | InChI=1S/C13H17N/c1-10(14-5)11-6-8-12(9-7-11)13(2,3)4/h6-10H,1-4H3 |
| InChIKey | DLABYMPFSLBTMO-UHFFFAOYSA-N |
| Mol Weight | 187.29 g/mol |
| Molecular Formula | C13H17N |
| Exact Mass | 187.1361 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1gcgRFqNDsY |
|---|---|
| Name | 1-tert-Butyl-4-(1-isocyanoethyl)benzene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H17N |
| InChI | InChI=1S/C13H17N/c1-10(14-5)11-6-8-12(9-7-11)13(2,3)4/h6-10H,1-4H3 |
| InChIKey | DLABYMPFSLBTMO-UHFFFAOYSA-N |
| Molecular Weight | 187.286 g/mol |
| SMILES | C([N+]#[C-])(c1ccc(C(C)(C)C)cc1)C |
| SPLASH | splash10-05fr-0900000000-1082651975a2ca6d63d3 |
| Source of Spectrum | F4-0-409-13 |
| Wiley ID | 1619282 |