| SpectraBase Compound ID | 5yt6XveHa5D |
|---|---|
| InChI | InChI=1S/C13H24O4/c1-10(2)8-16-11(14)6-7-12(15)17-9-13(3,4)5/h10H,6-9H2,1-5H3 |
| InChIKey | APPJUUNSUMLJDI-UHFFFAOYSA-N |
| Mol Weight | 244.33 g/mol |
| Molecular Formula | C13H24O4 |
| Exact Mass | 244.167459 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3xw27MPnnAz |
|---|---|
| Name | Succinic acid, isobutyl neopentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 244.167459249 u |
| Formula | C13H24O4 |
| InChI | InChI=1S/C13H24O4/c1-10(2)8-16-11(14)6-7-12(15)17-9-13(3,4)5/h10H,6-9H2,1-5H3 |
| InChIKey | APPJUUNSUMLJDI-UHFFFAOYSA-N |
| Molecular Weight | 244.331 g/mol |
| SMILES | C(CCC(OCC(C)(C)C)=O)(OCC(C)C)=O |