| SpectraBase Compound ID | J1JOTtY0hiX |
|---|---|
| InChI | InChI=1S/C16H23NO/c1-13(2)12-15(17-10-6-7-11-17)16(18)14-8-4-3-5-9-14/h3-5,8-9,13,15H,6-7,10-12H2,1-2H3 |
| InChIKey | UOZWZANRCOALQL-UHFFFAOYSA-N |
| Mol Weight | 245.37 g/mol |
| Molecular Formula | C16H23NO |
| Exact Mass | 245.177964 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 | LrRTl641GuK |
|---|---|
| Name | alpha-Pyrrolidinoisohexanophenone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 245.177964364 u |
| Formula | C16H23NO |
| InChI | InChI=1S/C16H23NO/c1-13(2)12-15(17-10-6-7-11-17)16(18)14-8-4-3-5-9-14/h3-5,8-9,13,15H,6-7,10-12H2,1-2H3 |
| InChIKey | UOZWZANRCOALQL-UHFFFAOYSA-N |
| Molecular Weight | 245.366 g/mol |
| SMILES | C1=CC=CC=C1C(C(CC(C)C)N1CCCC1)=O |