| SpectraBase Spectrum ID |
2QSEfdyqqLn |
| Name |
3,7-Dioxo-1-methylbicyclo[3,3,1]nonane-2,4,6,8-tetracarboxylic acid, tetramethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
398.121296898 u |
| Formula |
C18H22O10 |
| InChI |
InChI=1S/C18H22O10/c1-18-6-7(8(14(21)25-2)12(19)10(18)16(23)27-4)9(15(22)26-3)13(20)11(18)17(24)28-5/h7-11H,6H2,1-5H3 |
| InChIKey |
DIGIWMFWPLXODN-UHFFFAOYSA-N |
| Molecular Weight |
398.364 g/mol |
| SMILES |
C1(C(C2(C(C(C(C(C1C(OC)=O)C2)C(OC)=O)=O)C(OC)=O)C)C(=O)OC)=O |
| Spectrum/Structure Validation Score (Raman) |
0.905499 |
![3,7-Dioxo-1-methylbicyclo[3,3,1]nonane-2,4,6,8-tetracarboxylic acid, tetramethyl ester](/api/spectrum/2QSEfdyqqLn/structure.png?h=300&w=458 "3,7-Dioxo-1-methylbicyclo[3,3,1]nonane-2,4,6,8-tetracarboxylic acid, tetramethyl ester")
