| SpectraBase Spectrum ID |
DliRezg5Eju |
| Name |
Hexanedioic acid, 2-methyl-3-methylene-, dimethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
200.104858991 u |
| Formula |
C10H16O4 |
| InChI |
InChI=1S/C10H16O4/c1-7(5-6-9(11)13-3)8(2)10(12)14-4/h8H,1,5-6H2,2-4H3 |
| InChIKey |
SGMNBPBUIRPEQN-UHFFFAOYSA-N |
| Molecular Weight |
200.234 g/mol |
| SMILES |
CC(C(OC)=O)C(CCC(=O)OC)=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.974155 |
