| SpectraBase Compound ID | 335MH03vd9B |
|---|---|
| InChI | InChI=1S/C12H13NO/c1-12(2,3)11-5-4-9(8-14)6-10(11)7-13/h4-6,8H,1-3H3 |
| InChIKey | CYKGYQMNQAXTEN-UHFFFAOYSA-N |
| Mol Weight | 187.24 g/mol |
| Molecular Formula | C12H13NO |
| Exact Mass | 187.099714 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LEXVM0IHM0g |
|---|---|
| Name | 3-Cyano-4-(1,1-dimethylethyl)benzaldehyde |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H13NO |
| InChI | InChI=1S/C12H13NO/c1-12(2,3)11-5-4-9(8-14)6-10(11)7-13/h4-6,8H,1-3H3 |
| InChIKey | CYKGYQMNQAXTEN-UHFFFAOYSA-N |
| Molecular Weight | 187.242 g/mol |
| SMILES | C(c1cc(c(cc1)C(C)(C)C)C#N)=O |
| SPLASH | splash10-00di-0900000000-0b7e0a77d0cc25d0ace8 |
| Source of Spectrum | C-119-8800-11 |
| Synonyms | 2-tert-Butyl-5-formylbenzonitrile |
| Wiley ID | 760548 |