SpectraBase Spectrum ID |
KjA1mvsncpM |
Name |
2-Ethyl-3-methyl-8H-pyrano[2,3-H]isoquinolin-1-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
241.110278725 u |
Formula |
C15H15NO2 |
InChI |
InChI=1S/C15H15NO2/c1-3-16-10(2)9-11-6-7-13-12(5-4-8-18-13)14(11)15(16)17/h4-7,9H,3,8H2,1-2H3 |
InChIKey |
CFSUJTUORRPMBY-UHFFFAOYSA-N |
Molecular Weight |
241.290 g/mol |
SMILES |
C1(N(C(C)=CC2=C1C1=C(OCC=C1)C=C2)CC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.967163 |