| SpectraBase Compound ID | 5IdvQVSGjYy |
|---|---|
| InChI | InChI=1S/C19H24O4/c1-4-10-16(5-2)22-18(20)13-14-19(21)23-17(6-3)15-11-8-7-9-12-15/h7-9,11-12,16-17H,5-6,13-14H2,1-3H3 |
| InChIKey | NRJSAWAWRSPXOV-UHFFFAOYSA-N |
| Mol Weight | 316.4 g/mol |
| Molecular Formula | C19H24O4 |
| Exact Mass | 316.167459 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5YN3xqEpkcP |
|---|---|
| Name | Succinic acid, hex-4-yn-3-yl 1-phenylpropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 316.167459249 u |
| Formula | C19H24O4 |
| InChI | InChI=1S/C19H24O4/c1-4-10-16(5-2)22-18(20)13-14-19(21)23-17(6-3)15-11-8-7-9-12-15/h7-9,11-12,16-17H,5-6,13-14H2,1-3H3 |
| InChIKey | NRJSAWAWRSPXOV-UHFFFAOYSA-N |
| Molecular Weight | 316.397 g/mol |
| SMILES | C(CC(OC(CC)C#CC)=O)C(OC(CC)C1=CC=CC=C1)=O |