| SpectraBase Compound ID | 8fc3i2zjpHv |
|---|---|
| InChI | InChI=1S/C19H28O4/c1-4-6-7-10-15(3)22-18(20)13-14-19(21)23-17-12-9-8-11-16(17)5-2/h8-9,11-12,15H,4-7,10,13-14H2,1-3H3 |
| InChIKey | QAXUQJMCJKUSFS-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 | JstIgRSn1TA |
|---|---|
| Name | Succinic acid, hept-2-yl 2-ethylphenyl ester |
| 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/c1-4-6-7-10-15(3)22-18(20)13-14-19(21)23-17-12-9-8-11-16(17)5-2/h8-9,11-12,15H,4-7,10,13-14H2,1-3H3 |
| InChIKey | QAXUQJMCJKUSFS-UHFFFAOYSA-N |
| Molecular Weight | 320.429 g/mol |
| SMILES | C(CC(OC(C)CCCCC)=O)C(OC=1C(CC)=CC=CC1)=O |