| SpectraBase Compound ID | ALZdsaJJFxJ |
|---|---|
| InChI | InChI=1S/C12H23N/c1-3-4-5-6-7-8-9-12(2)10-11-13/h12H,3-10H2,1-2H3 |
| InChIKey | YBGLYNKRMUZVLM-UHFFFAOYSA-N |
| Mol Weight | 181.32 g/mol |
| Molecular Formula | C12H23N |
| Exact Mass | 181.18305 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | GM74SL4RBGE |
|---|---|
| Name | 3-Methylundecanenitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 181.183049745 u |
| Formula | C12H23N |
| InChI | InChI=1S/C12H23N/c1-3-4-5-6-7-8-9-12(2)10-11-13/h12H,3-10H2,1-2H3 |
| InChIKey | YBGLYNKRMUZVLM-UHFFFAOYSA-N |
| Molecular Weight | 181.323 g/mol |
| SMILES | C(CC(CCCCCCCC)C)#N |