| SpectraBase Compound ID | 5SuuBHwbneJ |
|---|---|
| InChI | InChI=1S/C22H28O4/c1-2-3-4-5-8-15-25-21(23)13-14-22(24)26-17-18-11-12-19-9-6-7-10-20(19)16-18/h6-7,9-12,16H,2-5,8,13-15,17H2,1H3 |
| InChIKey | YDIQIXXDDQOUKQ-UHFFFAOYSA-N |
| Mol Weight | 356.46 g/mol |
| Molecular Formula | C22H28O4 |
| Exact Mass | 356.198759 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6ipUkUxFc2R |
|---|---|
| Name | Succinic acid, heptyl 2-naphthylmethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 356.198759378 u |
| Formula | C22H28O4 |
| InChI | InChI=1S/C22H28O4/c1-2-3-4-5-8-15-25-21(23)13-14-22(24)26-17-18-11-12-19-9-6-7-10-20(19)16-18/h6-7,9-12,16H,2-5,8,13-15,17H2,1H3 |
| InChIKey | YDIQIXXDDQOUKQ-UHFFFAOYSA-N |
| Molecular Weight | 356.462 g/mol |
| SMILES | C(CC(OCCCCCCC)=O)C(OCC=1C=C2C=CC=CC2=CC1)=O |