SpectraBase Spectrum ID |
Ct6gSFHzfU9 |
Name |
N-Benzyl-3-ethyl-3-(4-fluorophenyl)-1,3-dihydropyrrol-2-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
295.137242366 u |
Formula |
C19H18FNO |
InChI |
InChI=1S/C19H18FNO/c1-2-19(16-8-10-17(20)11-9-16)12-13-21(18(19)22)14-15-6-4-3-5-7-15/h3-13H,2,14H2,1H3 |
InChIKey |
CGSLDBHYXRACKE-UHFFFAOYSA-N |
Molecular Weight |
295.357 g/mol |
SMILES |
C1(N(C=CC1(C1=CC=C(C=C1)F)CC)CC=1C=CC=CC1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.876342 |