SpectraBase Spectrum ID |
J0oZkqbkgxZ |
Name |
Dibenzo[B,G]cycloroazanonan-6,13-dione, 8-methoxy- |
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/c1-21-12-8-6-11-7-9-16(19)13-4-2-3-5-15(13)18-17(20)14(11)10-12/h2-6,8,10H,7,9H2,1H3,(H,18,20) |
InChIKey |
HFWPQWFJKTWRBL-UHFFFAOYSA-N |
SMILES |
C12=C(C=CC=C2)C(CCC2=C(C=C(C=C2)OC)C(N1)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.880027 |