SpectraBase Spectrum ID |
9VzR5oNzuvT |
Name |
6-Acetoxy-2,3-dihydro-2-phenyl-4-quinolone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
281.105193344 u |
Formula |
C17H15NO3 |
InChI |
InChI=1S/C17H15NO3/c1-11(19)21-13-7-8-15-14(9-13)17(20)10-16(18-15)12-5-3-2-4-6-12/h2-9,16,18H,10H2,1H3 |
InChIKey |
VQGMYMLJYJJAKS-UHFFFAOYSA-N |
SMILES |
C1(NC=2C=CC(=CC2C(C1)=O)OC(=O)C)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.969546 |