| SpectraBase Compound ID | 7F2y5SdWFi8 |
|---|---|
| InChI | InChI=1S/C18H26O4/c1-3-4-5-6-9-14-21-17(19)12-13-18(20)22-16-11-8-7-10-15(16)2/h7-8,10-11H,3-6,9,12-14H2,1-2H3 |
| InChIKey | MVHWOQWIFOTAQT-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 | Dsygc3e3Uyz |
|---|---|
| Name | Succinic acid, heptyl 2-methylphenyl 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/c1-3-4-5-6-9-14-21-17(19)12-13-18(20)22-16-11-8-7-10-15(16)2/h7-8,10-11H,3-6,9,12-14H2,1-2H3 |
| InChIKey | MVHWOQWIFOTAQT-UHFFFAOYSA-N |
| Molecular Weight | 306.402 g/mol |
| SMILES | CCCCCCCOC(CCC(OC1=CC=CC=C1C)=O)=O |