| SpectraBase Compound ID | 8wWfuIMupVX |
|---|---|
| InChI | InChI=1S/C21H26O4/c1-2-3-4-7-14-24-20(22)12-13-21(23)25-16-17-10-11-18-8-5-6-9-19(18)15-17/h5-6,8-11,15H,2-4,7,12-14,16H2,1H3 |
| InChIKey | HPMQNJNLRQOXLK-UHFFFAOYSA-N |
| Mol Weight | 342.44 g/mol |
| Molecular Formula | C21H26O4 |
| Exact Mass | 342.183109 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6pRp56JQPPp |
|---|---|
| Name | Succinic acid, hexyl 2-naphthylmethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 342.183109313 u |
| Formula | C21H26O4 |
| InChI | InChI=1S/C21H26O4/c1-2-3-4-7-14-24-20(22)12-13-21(23)25-16-17-10-11-18-8-5-6-9-19(18)15-17/h5-6,8-11,15H,2-4,7,12-14,16H2,1H3 |
| InChIKey | HPMQNJNLRQOXLK-UHFFFAOYSA-N |
| Molecular Weight | 342.435 g/mol |
| SMILES | C(CC(OCCCCCC)=O)C(OCC=1C=C2C=CC=CC2=CC1)=O |