| SpectraBase Compound ID | Arx68WaSoco |
|---|---|
| InChI | InChI=1S/C22H38O4/c1-2-3-4-5-6-7-8-9-13-18-25-21(23)16-17-22(24)26-19-20-14-11-10-12-15-20/h11,14,20H,2-10,12-13,15-19H2,1H3 |
| InChIKey | ADOWBPGIBHNHSZ-UHFFFAOYSA-N |
| Mol Weight | 366.5 g/mol |
| Molecular Formula | C22H38O4 |
| Exact Mass | 366.27701 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Lkg6Evkj75I |
|---|---|
| Name | Succinic acid, cyclohex-2-enylmethyl undecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 366.277009700 u |
| Formula | C22H38O4 |
| InChI | InChI=1S/C22H38O4/c1-2-3-4-5-6-7-8-9-13-18-25-21(23)16-17-22(24)26-19-20-14-11-10-12-15-20/h11,14,20H,2-10,12-13,15-19H2,1H3 |
| InChIKey | ADOWBPGIBHNHSZ-UHFFFAOYSA-N |
| Molecular Weight | 366.542 g/mol |
| SMILES | C(CCOC(CCC(OCC1C=CCCC1)=O)=O)CCCCCCCC |