| SpectraBase Compound ID | 6O0jG1EqlEE |
|---|---|
| InChI | InChI=1S/C19H28O4/c1-2-3-4-5-6-10-13-23-19(22)17(15-18(20)21)14-16-11-8-7-9-12-16/h7-9,11-12,17H,2-6,10,13-15H2,1H3,(H,20,21) |
| InChIKey | QARGSOMDIKDNGN-UHFFFAOYSA-N |
| Mol Weight | 320.43 g/mol |
| Molecular Formula | C19H28O4 |
| Exact Mass | 320.198759 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9N1zg16Xno3 |
|---|---|
| Name | N-Octyl benzylsuccinate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 320.198759378 u |
| Formula | C19H28O4 |
| InChI | InChI=1S/C19H28O4/c1-2-3-4-5-6-10-13-23-19(22)17(15-18(20)21)14-16-11-8-7-9-12-16/h7-9,11-12,17H,2-6,10,13-15H2,1H3,(H,20,21) |
| InChIKey | QARGSOMDIKDNGN-UHFFFAOYSA-N |
| Molecular Weight | 320.429 g/mol |
| SMILES | C(C(CC(=O)O)CC1=CC=CC=C1)(=O)OCCCCCCCC |