| SpectraBase Compound ID | LnBFh2aVFwr |
|---|---|
| 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 |
| Mol Weight | 200.23 g/mol |
| Molecular Formula | C10H16O4 |
| Exact Mass | 200.104859 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EBU3vwkxkm9 |
|---|---|
| Name | Hexanedioic acid, 2-methyl-3-methylene-, dimethyl ester |
| Comments | Computed using HOSE algorithm |
| 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 |