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9-Methoxy-N-benzylphenanthridin-6-one

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

9-Methoxy-N-benzylphenanthridin-6-one
SpectraBase Compound ID DLZXc18xdZW
InChI InChI=1S/C21H17NO2/c1-24-16-11-12-18-19(13-16)17-9-5-6-10-20(17)22(21(18)23)14-15-7-3-2-4-8-15/h2-13H,14H2,1H3
InChIKey PXBVWZBGJYVILI-UHFFFAOYSA-N
Mol Weight 315.37 g/mol
Molecular Formula C21H17NO2
Exact Mass 315.125929 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FEKJ3PVYfmw
Name 9-Methoxy-N-benzylphenanthridin-6-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 315.125928789 u
Formula C21H17NO2
InChI InChI=1S/C21H17NO2/c1-24-16-11-12-18-19(13-16)17-9-5-6-10-20(17)22(21(18)23)14-15-7-3-2-4-8-15/h2-13H,14H2,1H3
InChIKey PXBVWZBGJYVILI-UHFFFAOYSA-N
SMILES C1(N(C=2C(C=3C=C(C=CC13)OC)=CC=CC2)CC1=CC=CC=C1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.858212