SpectraBase Spectrum ID |
F6WI9nArfQA |
Name |
8-Acetyl-6-(naphthalen-2-yl)-2,3-dihydroindolizin-5(1H)-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
303.125928789 u |
Formula |
C20H17NO2 |
InChI |
InChI=1S/C20H17NO2/c1-13(22)17-12-18(20(23)21-10-4-7-19(17)21)16-9-8-14-5-2-3-6-15(14)11-16/h2-3,5-6,8-9,11-12H,4,7,10H2,1H3 |
InChIKey |
YUAADRMRZFOAOB-UHFFFAOYSA-N |
SMILES |
C1CCN2C1=C(C=C(C2=O)C1=CC2=C(C=C1)C=CC=C2)C(=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.821448 |