| SpectraBase Spectrum ID |
EIqRxGfb27A |
| Name |
5-Keto-2H-pyrano[3,2-C]chromene-2,3-dicarboxylic acid dimethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
316.058302719 u |
| Formula |
C16H12O7 |
| InChI |
InChI=1S/C16H12O7/c1-20-14(17)10-7-9-12(23-13(10)16(19)21-2)8-5-3-4-6-11(8)22-15(9)18/h3-7,13H,1-2H3 |
| InChIKey |
KHYCALOCFPSKMR-UHFFFAOYSA-N |
| Molecular Weight |
316.265 g/mol |
| SMILES |
C12=C(OC(C(=C2)C(=O)OC)C(=O)OC)C2=CC=CC=C2OC1=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.984288 |
![5-keto-2H-pyrano[3,2-c]chromene-2,3-dicarboxylic acid dimethyl ester](/api/spectrum/EIqRxGfb27A/structure.png?h=300&w=458 "5-keto-2H-pyrano[3,2-c]chromene-2,3-dicarboxylic acid dimethyl ester")
