| SpectraBase Compound ID | 4xe1Uv97ZV9 |
|---|---|
| InChI | InChI=1S/C14H26O4/c1-6-7-11(4)17-13(15)8-9-14(16)18-12(5)10(2)3/h10-12H,6-9H2,1-5H3 |
| InChIKey | JONOCWHTZOAQQC-UHFFFAOYSA-N |
| Mol Weight | 258.36 g/mol |
| Molecular Formula | C14H26O4 |
| Exact Mass | 258.183109 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3vLLQD7gT4x |
|---|---|
| Name | Succinic acid, 3-methyl-2-butyl 2-pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 258.183109313 u |
| Formula | C14H26O4 |
| InChI | InChI=1S/C14H26O4/c1-6-7-11(4)17-13(15)8-9-14(16)18-12(5)10(2)3/h10-12H,6-9H2,1-5H3 |
| InChIKey | JONOCWHTZOAQQC-UHFFFAOYSA-N |
| Molecular Weight | 258.358 g/mol |
| SMILES | CCCC(OC(CCC(=O)OC(C(C)C)C)=O)C |