| SpectraBase Compound ID | 2p6JXQ5n2HR |
|---|---|
| InChI | InChI=1S/C12H18N2O3/c13-9-5-1-2-7-11(14(16)17)10-6-3-4-8-12(10)15/h10-11H,1-8H2 |
| InChIKey | CFNRMAVXRYVALV-UHFFFAOYSA-N |
| Mol Weight | 238.29 g/mol |
| Molecular Formula | C12H18N2O3 |
| Exact Mass | 238.131742 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AeJBxJRiXZ0 |
|---|---|
| Name | 6-Nitro-6-(oxocyclohexyl)hexanenitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H18N2O3 |
| InChI | InChI=1S/C12H18N2O3/c13-9-5-1-2-7-11(14(16)17)10-6-3-4-8-12(10)15/h10-11H,1-8H2 |
| InChIKey | CFNRMAVXRYVALV-UHFFFAOYSA-N |
| Molecular Weight | 238.287 g/mol |
| SMILES | C(CCCCC(C1C(CCCC1)=O)N(=O)=O)#N |
| SPLASH | splash10-05mp-9500000000-adfeb0809189e4063eb8 |
| Source of Spectrum | F-68-5855-3ic |
| Wiley ID | 1717316 |