| SpectraBase Compound ID | 4jyQkA2AE5k |
|---|---|
| InChI | InChI=1S/C17H32O5/c1-14(2)7-6-11-21-16(18)8-5-9-17(19)22-13-15(3)10-12-20-4/h14-15H,5-13H2,1-4H3 |
| InChIKey | AURQYPVLOWIYHQ-UHFFFAOYSA-N |
| Mol Weight | 316.4 g/mol |
| Molecular Formula | C17H32O5 |
| Exact Mass | 316.224974 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Hf9rN6aTbF2 |
|---|---|
| Name | Glutaric acid, isohexyl 4-methoxy-2-methylbutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 316.224974125 u |
| Formula | C17H32O5 |
| InChI | InChI=1S/C17H32O5/c1-14(2)7-6-11-21-16(18)8-5-9-17(19)22-13-15(3)10-12-20-4/h14-15H,5-13H2,1-4H3 |
| InChIKey | AURQYPVLOWIYHQ-UHFFFAOYSA-N |
| Molecular Weight | 316.438 g/mol |
| SMILES | CC(C)CCCOC(CCCC(OCC(CCOC)C)=O)=O |