| SpectraBase Compound ID | AcXbPl1IpkF |
|---|---|
| InChI | InChI=1S/C16H19NO2/c1-3-16(19,4-2)14-10-11-15(18)17(14)12-13-8-6-5-7-9-13/h3-9,14,19H,1-2,10-12H2/t14-/m0/s1 |
| InChIKey | LQWSGLMWOQPINW-AWEZNQCLSA-N |
| Mol Weight | 257.33 g/mol |
| Molecular Formula | C16H19NO2 |
| Exact Mass | 257.141579 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CsQQ4ToWK41 |
|---|---|
| Name | (5S)-1-Benzyl-5-(1-hydroxy-1-vinyl-allyl)-2-pyrrolidone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 257.141578854 u |
| Formula | C16H19NO2 |
| InChI | InChI=1S/C16H19NO2/c1-3-16(19,4-2)14-10-11-15(18)17(14)12-13-8-6-5-7-9-13/h3-9,14,19H,1-2,10-12H2/t14-/m0/s1 |
| InChIKey | LQWSGLMWOQPINW-AWEZNQCLSA-N |
| Molecular Weight | 257.333 g/mol |
| SMILES | [C@]1(N(C(CC1)=O)CC1=CC=CC=C1)(C(C=C)(C=C)O)[H] |