| SpectraBase Compound ID | 518RtfGNICD |
|---|---|
| InChI | InChI=1S/C24H46O4/c1-6-7-8-9-10-11-12-13-14-15-16-19-27-22(25)17-18-23(26)28-24(20(2)3)21(4)5/h20-21,24H,6-19H2,1-5H3 |
| InChIKey | PTKRMGSCPPZYCL-UHFFFAOYSA-N |
| Mol Weight | 398.6 g/mol |
| Molecular Formula | C24H46O4 |
| Exact Mass | 398.33961 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4GInj9kkA9o |
|---|---|
| Name | Succinic acid, 2,4-dimethylpent-3-yl tridecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 398.339609957 u |
| Formula | C24H46O4 |
| InChI | InChI=1S/C24H46O4/c1-6-7-8-9-10-11-12-13-14-15-16-19-27-22(25)17-18-23(26)28-24(20(2)3)21(4)5/h20-21,24H,6-19H2,1-5H3 |
| InChIKey | PTKRMGSCPPZYCL-UHFFFAOYSA-N |
| Molecular Weight | 398.628 g/mol |
| SMILES | C(OC(C(C)C)C(C)C)(CCC(OCCCCCCCCCCCCC)=O)=O |