| SpectraBase Spectrum ID |
FlndrJHLqCH |
| Name |
(8-Methoxy-1,3-dioxo-4H-isochromen-6-yl) acetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
250.047738036 u |
| Formula |
C12H10O6 |
| InChI |
InChI=1S/C12H10O6/c1-6(13)17-8-3-7-4-10(14)18-12(15)11(7)9(5-8)16-2/h3,5H,4H2,1-2H3 |
| InChIKey |
OUUZSELTQUTJTL-UHFFFAOYSA-N |
| Molecular Weight |
250.206 g/mol |
| SMILES |
C1(C=2C(=CC(=CC2OC)OC(=O)C)CC(O1)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.967882 |
