SpectraBase Spectrum ID |
ICrBjZ9YgCN |
Name |
1,2,3,4-Tetrahydro-6,7-dimethoxy-9-acridanone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
259.120843408 u |
Formula |
C15H17NO3 |
InChI |
InChI=1S/C15H17NO3/c1-18-13-7-10-12(8-14(13)19-2)16-11-6-4-3-5-9(11)15(10)17/h7-8H,3-6H2,1-2H3,(H,16,17) |
InChIKey |
QCHOUILXBOEABW-UHFFFAOYSA-N |
Molecular Weight |
259.305 g/mol |
SMILES |
C1(=CC=2C(C=3CCCCC3NC2C=C1OC)=O)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.840677 |