| SpectraBase Compound ID | H4MXvnYeW9e |
|---|---|
| InChI | InChI=1S/C16H22O4/c1-13(2)12-20-16(18)9-8-15(17)19-11-10-14-6-4-3-5-7-14/h3-7,13H,8-12H2,1-2H3 |
| InChIKey | MIPYYWIFVZWQMN-UHFFFAOYSA-N |
| Mol Weight | 278.35 g/mol |
| Molecular Formula | C16H22O4 |
| Exact Mass | 278.151809 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LG6sXE6qlEH |
|---|---|
| Name | Succinic acid, isobutyl 2-phenylethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 278.151809184 u |
| Formula | C16H22O4 |
| InChI | InChI=1S/C16H22O4/c1-13(2)12-20-16(18)9-8-15(17)19-11-10-14-6-4-3-5-7-14/h3-7,13H,8-12H2,1-2H3 |
| InChIKey | MIPYYWIFVZWQMN-UHFFFAOYSA-N |
| Molecular Weight | 278.348 g/mol |
| SMILES | C(C(OCCC1=CC=CC=C1)=O)CC(OCC(C)C)=O |