| SpectraBase Compound ID | HBkuOMEUvLn |
|---|---|
| InChI | InChI=1S/C11H9NO/c1-8(13)11-6-9-4-2-3-5-10(9)7-12-11/h2-7H,1H3 |
| InChIKey | NLMXNLJJYMMQIF-UHFFFAOYSA-N |
| Mol Weight | 171.2 g/mol |
| Molecular Formula | C11H9NO |
| Exact Mass | 171.068414 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 6oHLL83zHtd |
|---|---|
| Name | 1-(Isoquinolin-3-yl)ethanone |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H9NO |
| InChI | InChI=1S/C11H9NO/c1-8(13)11-6-9-4-2-3-5-10(9)7-12-11/h2-7H,1H3 |
| InChIKey | NLMXNLJJYMMQIF-UHFFFAOYSA-N |
| Molecular Weight | 171.199 g/mol |
| SMILES | C(C)(c1ncc2c(c1)cccc2)=O |
| SPLASH | splash10-004i-1900000000-44977622a01f3c3dbb7e |
| Source of Spectrum | KD-12-1192-6 |
| Synonyms | 1-(3-Isoquinolinyl)ethanone 1-(3-Isoquinolyl)ethanone |
| Wiley ID | 1634394 |