| SpectraBase Compound ID | 6fX21blR5mj |
|---|---|
| InChI | InChI=1S/C8H13NO/c1-7-3-2-4-8(10-7)5-6-9/h7-8H,2-5H2,1H3/t7-,8-/m1/s1 |
| InChIKey | WSOKFQNITLTPPU-HTQZYQBOSA-N |
| Mol Weight | 139.2 g/mol |
| Molecular Formula | C8H13NO |
| Exact Mass | 139.099714 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 | 77bOUvXsPkU |
|---|---|
| Name | 2H-Pyran-2-acetonitrile, tetrahydro-6-methyl-, cis-(.+-.)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 139.099714042 u |
| Formula | C8H13NO |
| InChI | InChI=1S/C8H13NO/c1-7-3-2-4-8(10-7)5-6-9/h7-8H,2-5H2,1H3/t7-,8-/m1/s1 |
| InChIKey | WSOKFQNITLTPPU-HTQZYQBOSA-N |
| Molecular Weight | 139.198 g/mol |
| SMILES | C(#N)C[C@@]1(O[C@](C)(CCC1)[H])[H] |