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N-acetyl-9-phenyl-(?-acetoxy)indeno[2,1-c]pyridine
SpectraBase Compound ID 8ZIP2pZKi04
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
Mol Weight 347.41 g/mol
Molecular Formula C22H21NO3
Exact Mass 347.152144 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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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