SpectraBase Spectrum ID |
D0xyIlCspab |
Name |
N-Acetyl-9-phenyl-(?-acetoxy)indeno[2,1-C]pyridine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
347.152143537 u |
Formula |
C22H21NO3 |
InChI |
InChI=1S/C22H21NO3/c1-14(24)23-12-11-19-18-5-3-4-6-20(18)22(21(19)13-23)16-7-9-17(10-8-16)26-15(2)25/h3-12,19,21-22H,13H2,1-2H3 |
InChIKey |
ANOLKCMRUIZVLC-UHFFFAOYSA-N |
Molecular Weight |
347.414 g/mol |
SMILES |
C12C(C=3C=CC=CC3C2C=2C=CC(OC(=O)C)=CC2)C=CN(C1)C(=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.917284 |