| SpectraBase Compound ID | Llh98KsJy1d |
|---|---|
| InChI | InChI=1S/C23H28O4/c1-2-3-4-10-18-26-22(24)16-11-17-23(25)27-21-15-9-8-14-20(21)19-12-6-5-7-13-19/h5-9,12-15H,2-4,10-11,16-18H2,1H3 |
| InChIKey | SZXMBKJMQWMLIE-UHFFFAOYSA-N |
| Mol Weight | 368.47 g/mol |
| Molecular Formula | C23H28O4 |
| Exact Mass | 368.198759 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3FimyaMgkje |
|---|---|
| Name | Glutaric acid, 2-biphenyl hexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 368.198759378 u |
| Formula | C23H28O4 |
| InChI | InChI=1S/C23H28O4/c1-2-3-4-10-18-26-22(24)16-11-17-23(25)27-21-15-9-8-14-20(21)19-12-6-5-7-13-19/h5-9,12-15H,2-4,10-11,16-18H2,1H3 |
| InChIKey | SZXMBKJMQWMLIE-UHFFFAOYSA-N |
| Molecular Weight | 368.473 g/mol |
| SMILES | CCCCCCOC(CCCC(OC1=CC=CC=C1C1=CC=CC=C1)=O)=O |