| SpectraBase Compound ID | D1TmqS204pr |
|---|---|
| InChI | InChI=1S/C21H40O5/c1-6-8-9-10-11-12-13-14-17-24-18(22)15-16-19(23)25-20(7-2)26-21(3,4)5/h20H,6-17H2,1-5H3 |
| InChIKey | CIDRTPTZGFUGDO-UHFFFAOYSA-N |
| Mol Weight | 372.5 g/mol |
| Molecular Formula | C21H40O5 |
| Exact Mass | 372.287574 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1qrijVr1LbR |
|---|---|
| Name | Succinic acid, decyl 1-tert-butoxyprop-2-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 372.287574383 u |
| Formula | C21H40O5 |
| InChI | InChI=1S/C21H40O5/c1-6-8-9-10-11-12-13-14-17-24-18(22)15-16-19(23)25-20(7-2)26-21(3,4)5/h20H,6-17H2,1-5H3 |
| InChIKey | CIDRTPTZGFUGDO-UHFFFAOYSA-N |
| Molecular Weight | 372.546 g/mol |
| SMILES | C(OC(OC(C)(C)C)CC)(=O)CCC(OCCCCCCCCCC)=O |