| SpectraBase Compound ID | 5e63OEycsHF |
|---|---|
| InChI | InChI=1S/C15H20O5/c1-3-9-18-14(16)11-12-5-7-13(8-6-12)20-15(17)19-10-4-2/h5-8H,3-4,9-11H2,1-2H3 |
| InChIKey | IRQDEBIHQLXAHF-UHFFFAOYSA-N |
| Mol Weight | 280.32 g/mol |
| Molecular Formula | C15H20O5 |
| Exact Mass | 280.131074 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9sJtYr7vEnH |
|---|---|
| Name | (4-(N-Propyloxycarbonyl)oxyphenyl)acetic acid, N-propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.131073739 u |
| Formula | C15H20O5 |
| InChI | InChI=1S/C15H20O5/c1-3-9-18-14(16)11-12-5-7-13(8-6-12)20-15(17)19-10-4-2/h5-8H,3-4,9-11H2,1-2H3 |
| InChIKey | IRQDEBIHQLXAHF-UHFFFAOYSA-N |
| SMILES | C(CC1=CC=C(C=C1)OC(OCCC)=O)(OCCC)=O |