| SpectraBase Compound ID | DB4d3UnqdSR |
|---|---|
| InChI | InChI=1S/C11H12N2/c1-13-6-5-9-3-2-4-10(7-12)11(9)8-13/h2-4H,5-6,8H2,1H3 |
| InChIKey | KMJTVCSGZCTHBY-UHFFFAOYSA-N |
| Mol Weight | 172.23 g/mol |
| Molecular Formula | C11H12N2 |
| Exact Mass | 172.100048 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 27xvGlh3hsc |
|---|---|
| Name | 8-Isoquinolinecarbonitrile, 1,2,3,4-tetrahydro-2-methyl- |
| CAS Registry Number | 104737-07-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H12N2 |
| InChI | InChI=1S/C11H12N2/c1-13-6-5-9-3-2-4-10(7-12)11(9)8-13/h2-4H,5-6,8H2,1H3 |
| InChIKey | KMJTVCSGZCTHBY-UHFFFAOYSA-N |
| Molecular Weight | 172.231 g/mol |
| SMILES | c12CN(C)CCc2cccc1C#N |
| SPLASH | splash10-00di-0900000000-3dea4051617eb8a7b588 |
| Source of Spectrum | H-68-1833-13 |
| Wiley ID | 1169309 |