| SpectraBase Compound ID | C8aXlSyxAw7 |
|---|---|
| InChI | InChI=1S/C12H15NO2/c1-11(2)5-9(14)8-4-12(3,7-13)15-10(8)6-11/h4-6H2,1-3H3 |
| InChIKey | GXGUROUVRDMWDW-UHFFFAOYSA-N |
| Mol Weight | 205.26 g/mol |
| Molecular Formula | C12H15NO2 |
| Exact Mass | 205.110279 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FwkAA0BCdIH |
|---|---|
| Name | 2-Cyano-2,6,6-trimethyl-4,5,6,7-tetrahydrobenzofuran-4-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H15NO2 |
| InChI | InChI=1S/C12H15NO2/c1-11(2)5-9(14)8-4-12(3,7-13)15-10(8)6-11/h4-6H2,1-3H3 |
| InChIKey | GXGUROUVRDMWDW-UHFFFAOYSA-N |
| Molecular Weight | 205.257 g/mol |
| SMILES | C12=C(OC(C2)(C#N)C)CC(CC1=O)(C)C |
| SPLASH | splash10-0a4i-4690000000-db23b546e1b95dfcc569 |
| Source of Spectrum | H1-48-882-21 |
| Wiley ID | 816291 |