| SpectraBase Compound ID | Gc7AeaKPKGr |
|---|---|
| InChI | InChI=1S/C18H18O3/c19-18(15-7-4-8-15)21-17-11-9-16(10-12-17)20-13-14-5-2-1-3-6-14/h1-3,5-6,9-12,15H,4,7-8,13H2 |
| InChIKey | MLTQEXIFKGNXBF-UHFFFAOYSA-N |
| Mol Weight | 282.34 g/mol |
| Molecular Formula | C18H18O3 |
| Exact Mass | 282.125594 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Jb7tHzwVZ62 |
|---|---|
| Name | Cyclobutanecarboxylic acid, 4-benzyloxyphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.125594437 u |
| Formula | C18H18O3 |
| InChI | InChI=1S/C18H18O3/c19-18(15-7-4-8-15)21-17-11-9-16(10-12-17)20-13-14-5-2-1-3-6-14/h1-3,5-6,9-12,15H,4,7-8,13H2 |
| InChIKey | MLTQEXIFKGNXBF-UHFFFAOYSA-N |
| SMILES | C1(CCC1)C(OC1=CC=C(C=C1)OCC1=CC=CC=C1)=O |