| SpectraBase Compound ID | 7OgUmDrcOwZ |
|---|---|
| InChI | InChI=1S/C15H24O4/c1-6-8-12(7-2)19-14(17)10-9-13(16)18-11-15(3,4)5/h12H,7,9-11H2,1-5H3 |
| InChIKey | PEMAPPXRABBIET-UHFFFAOYSA-N |
| Mol Weight | 268.35 g/mol |
| Molecular Formula | C15H24O4 |
| Exact Mass | 268.167459 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AHFoknqIcB4 |
|---|---|
| Name | Succinic acid, hex-4-yn-3-yl neopentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.167459249 u |
| Formula | C15H24O4 |
| InChI | InChI=1S/C15H24O4/c1-6-8-12(7-2)19-14(17)10-9-13(16)18-11-15(3,4)5/h12H,7,9-11H2,1-5H3 |
| InChIKey | PEMAPPXRABBIET-UHFFFAOYSA-N |
| Molecular Weight | 268.353 g/mol |
| SMILES | C(CC(OC(CC)C#CC)=O)C(OCC(C)(C)C)=O |