| SpectraBase Spectrum ID |
bA5yugs7VS |
| Name |
(S)-1-Benzyl-3-[(2'-hydroxyphenyl)carbonyl]-4,5,5-trimethylpyrrolidin-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
337.167793602 u |
| Formula |
C21H23NO3 |
| InChI |
InChI=1S/C21H23NO3/c1-14-18(19(24)16-11-7-8-12-17(16)23)20(25)22(21(14,2)3)13-15-9-5-4-6-10-15/h4-12,14,18,23H,13H2,1-3H3/t14?,18-/m0/s1 |
| InChIKey |
JPWNVKWBZXIFDZ-IBYPIGCZSA-N |
| Molecular Weight |
337.419 g/mol |
| SMILES |
C1(N(C(C([C@]1(C(C=1C(O)=CC=CC1)=O)[H])C)(C)C)CC=1C=CC=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.953867 |
![(S)-1-Benzyl-3-[(2'-hydroxyphenyl)carbonyl]-4,5,5-trimethylpyrrolidin-2-one](/api/spectrum/bA5yugs7VS/structure.png?h=300&w=458 "(S)-1-Benzyl-3-[(2'-hydroxyphenyl)carbonyl]-4,5,5-trimethylpyrrolidin-2-one")
