| SpectraBase Compound ID | 2r0U1o3065e |
|---|---|
| InChI | InChI=1S/C11H13NO.2C3H6/c13-11-8-4-5-9-12(11)10-6-2-1-3-7-10;2*1-3-2/h1-3,6-7H,4-5,8-9H2;2*3H,1H2,2H3 |
| InChIKey | FNPNUOVHDVFOCN-UHFFFAOYSA-N |
| Mol Weight | 259.39 g/mol |
| Molecular Formula | C17H25NO |
| Exact Mass | 259.193614 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4mIwl7kkbu2 |
|---|---|
| Name | 2-Piperidinone, 3,6-bis(1-methylethenyl)-1-phenyl-, cis- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 259.193614428 u |
| Formula | C17H25NO |
| InChI | InChI=1S/C11H13NO.2C3H6/c13-11-8-4-5-9-12(11)10-6-2-1-3-7-10;2*1-3-2/h1-3,6-7H,4-5,8-9H2;2*3H,1H2,2H3 |
| InChIKey | FNPNUOVHDVFOCN-UHFFFAOYSA-N |
| Molecular Weight | 259.393 g/mol |
| Nominal Mass | 259 u |
| SMILES | C(=C)C.c1(ccccc1)N1C(=O)CCCC1.C(=C)C |