| SpectraBase Compound ID | F5joGiWDrIj |
|---|---|
| InChI | InChI=1S/C18H26O4/c1-13(2)7-6-12-21-17(19)10-11-18(20)22-16-9-5-8-14(3)15(16)4/h5,8-9,13H,6-7,10-12H2,1-4H3 |
| InChIKey | VHLANOOFCYNUCM-UHFFFAOYSA-N |
| Mol Weight | 306.4 g/mol |
| Molecular Formula | C18H26O4 |
| Exact Mass | 306.183109 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KiJDsRwDkPI |
|---|---|
| Name | Succinic acid, 2,3-dimethylphenyl isohexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 306.183109313 u |
| Formula | C18H26O4 |
| InChI | InChI=1S/C18H26O4/c1-13(2)7-6-12-21-17(19)10-11-18(20)22-16-9-5-8-14(3)15(16)4/h5,8-9,13H,6-7,10-12H2,1-4H3 |
| InChIKey | VHLANOOFCYNUCM-UHFFFAOYSA-N |
| Molecular Weight | 306.402 g/mol |
| SMILES | C(CC(OC1=C(C(C)=CC=C1)C)=O)C(OCCCC(C)C)=O |