| SpectraBase Spectrum ID |
8LoUrVCvp7d |
| Name |
1,2-Diacetyl-3-methylene-cyclobutane-1,2-dicarboxylic acid diethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
296.125988358 u |
| Formula |
C15H20O6 |
| InChI |
InChI=1S/C15H20O6/c1-6-20-12(18)14(10(4)16)8-9(3)15(14,11(5)17)13(19)21-7-2/h3,6-8H2,1-2,4-5H3 |
| InChIKey |
BJSFLZLSLNUPMN-UHFFFAOYSA-N |
| SMILES |
C1(C(C(=O)OCC)(C(=O)C)C(C1)=C)(C(=O)OCC)C(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.944377 |
