| SpectraBase Compound ID | KGUWadbehUJ |
|---|---|
| InChI | InChI=1S/C19H36O4/c1-7-10-16(14(3)4)22-18(20)12-9-13-19(21)23-17(11-8-2)15(5)6/h14-17H,7-13H2,1-6H3 |
| InChIKey | XVMWQYYVSVLKNR-UHFFFAOYSA-N |
| Mol Weight | 328.5 g/mol |
| Molecular Formula | C19H36O4 |
| Exact Mass | 328.26136 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 43kXBSxxs4c |
|---|---|
| Name | Glutaric acid, di(2-methylhex-3-yl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 328.261359635 u |
| Formula | C19H36O4 |
| InChI | InChI=1S/C19H36O4/c1-7-10-16(14(3)4)22-18(20)12-9-13-19(21)23-17(11-8-2)15(5)6/h14-17H,7-13H2,1-6H3 |
| InChIKey | XVMWQYYVSVLKNR-UHFFFAOYSA-N |
| Molecular Weight | 328.493 g/mol |
| SMILES | C(CCC(OC(C(C)C)CCC)=O)C(OC(C(C)C)CCC)=O |