| SpectraBase Compound ID | HKrriPX5fTw |
|---|---|
| InChI | InChI=1S/C18H26O4/c1-5-16(15-9-7-6-8-10-15)22-18(20)12-11-17(19)21-14(4)13(2)3/h6-10,13-14,16H,5,11-12H2,1-4H3 |
| InChIKey | BIJZEPKVXUHZMM-UHFFFAOYSA-N |
| Mol Weight | 306.4 g/mol |
| Molecular Formula | C18H26O4 |
| Exact Mass | 306.183109 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 235cAoiXcUg |
|---|---|
| Name | Succinic acid, 3-methylbut-2-yl 1-phenylpropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 306.183109313 u |
| Formula | C18H26O4 |
| InChI | InChI=1S/C18H26O4/c1-5-16(15-9-7-6-8-10-15)22-18(20)12-11-17(19)21-14(4)13(2)3/h6-10,13-14,16H,5,11-12H2,1-4H3 |
| InChIKey | BIJZEPKVXUHZMM-UHFFFAOYSA-N |
| Molecular Weight | 306.402 g/mol |
| SMILES | C(CC(OC(C(C)C)C)=O)C(OC(CC)C1=CC=CC=C1)=O |