| SpectraBase Compound ID | 8dfEOElcfdY |
|---|---|
| InChI | InChI=1S/C14H17NO/c1-11(2)13-8-9-14(16)15(13)10-12-6-4-3-5-7-12/h3-7,13H,1,8-10H2,2H3/t13-/m0/s1 |
| InChIKey | XCVHAOCKJKHCJE-ZDUSSCGKSA-N |
| Mol Weight | 215.3 g/mol |
| Molecular Formula | C14H17NO |
| Exact Mass | 215.131014 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3OTVD14FWsT |
|---|---|
| Name | (5S)-1-(Phenylmethyl)-5-prop-1-en-2-yl-pyrrolidin-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 215.131014170 u |
| Formula | C14H17NO |
| InChI | InChI=1S/C14H17NO/c1-11(2)13-8-9-14(16)15(13)10-12-6-4-3-5-7-12/h3-7,13H,1,8-10H2,2H3/t13-/m0/s1 |
| InChIKey | XCVHAOCKJKHCJE-ZDUSSCGKSA-N |
| Molecular Weight | 215.296 g/mol |
| SMILES | C1(N([C@@](CC1)(C(=C)C)[H])CC=1C=CC=CC1)=O |