| SpectraBase Compound ID | 43wm696sF1k |
|---|---|
| InChI | InChI=1S/C12H21N/c1-3-12(2)10-8-6-4-5-7-9-11-13/h8,10,12H,3-7,9H2,1-2H3/b10-8+ |
| InChIKey | UENLIEFFUAIASJ-CSKARUKUSA-N |
| Mol Weight | 179.31 g/mol |
| Molecular Formula | C12H21N |
| Exact Mass | 179.1674 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 | 1cI5OHFMftv |
|---|---|
| Name | (E)-9-Methyl-7-undecenenitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 179.167399680 u |
| Formula | C12H21N |
| InChI | InChI=1S/C12H21N/c1-3-12(2)10-8-6-4-5-7-9-11-13/h8,10,12H,3-7,9H2,1-2H3/b10-8+ |
| InChIKey | UENLIEFFUAIASJ-CSKARUKUSA-N |
| Molecular Weight | 179.307 g/mol |
| SMILES | C(CCCCC\C=C\C(CC)C)#N |