| SpectraBase Compound ID | IT9VHbYMeAw |
|---|---|
| InChI | InChI=1S/C18H32O4/c1-4-5-6-7-8-9-10-14-21-17(19)11-12-18(20)22-15-13-16(2)3/h2,4-15H2,1,3H3 |
| InChIKey | MLIHBBWEWPFUOJ-UHFFFAOYSA-N |
| Mol Weight | 312.5 g/mol |
| Molecular Formula | C18H32O4 |
| Exact Mass | 312.23006 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GQM42l2rfLn |
|---|---|
| Name | Succinic acid, 3-methylbut-3-enyl nonyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.230059506 u |
| Formula | C18H32O4 |
| InChI | InChI=1S/C18H32O4/c1-4-5-6-7-8-9-10-14-21-17(19)11-12-18(20)22-15-13-16(2)3/h2,4-15H2,1,3H3 |
| InChIKey | MLIHBBWEWPFUOJ-UHFFFAOYSA-N |
| Molecular Weight | 312.450 g/mol |
| SMILES | CC(=C)CCOC(CCC(OCCCCCCCCC)=O)=O |