SpectraBase Spectrum ID |
55Msd5s5E3L |
Name |
Dimethyl 7-acetylamino-5-oxo-4H-benzo[C]-2H-chromen-8,9-dicarboxylate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
369.084851820 u |
Formula |
C19H15NO7 |
InChI |
InChI=1S/C19H15NO7/c1-9(21)20-16-14-11(10-6-4-5-7-13(10)27-19(14)24)8-12(17(22)25-2)15(16)18(23)26-3/h4-8H,1-3H3,(H,20,21) |
InChIKey |
POHJQZAIZBFATJ-UHFFFAOYSA-N |
Molecular Weight |
369.329 g/mol |
SMILES |
C1=2C(OC=3C(C2C=C(C(=O)OC)C(=C1NC(=O)C)C(=O)OC)=CC=CC3)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.945471 |