| SpectraBase Compound ID | 2Weevq5yh01 |
|---|---|
| InChI | InChI=1S/C19H18O2/c1-2-3-12-21-19(20)18-16-10-6-4-8-14(16)13-15-9-5-7-11-17(15)18/h4-11,13H,2-3,12H2,1H3 |
| InChIKey | DCEMMMPTENZLNZ-UHFFFAOYSA-N |
| Mol Weight | 278.35 g/mol |
| Molecular Formula | C19H18O2 |
| Exact Mass | 278.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6hkVJRvWEu4 |
|---|---|
| Name | 9-Anthracenecarboxylic acid, butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 278.130679818 u |
| Formula | C19H18O2 |
| InChI | InChI=1S/C19H18O2/c1-2-3-12-21-19(20)18-16-10-6-4-8-14(16)13-15-9-5-7-11-17(15)18/h4-11,13H,2-3,12H2,1H3 |
| InChIKey | DCEMMMPTENZLNZ-UHFFFAOYSA-N |
| Molecular Weight | 278.351 g/mol |
| SMILES | C1=C2C=C3C=CC=CC3=C(C2=CC=C1)C(=O)OCCCC |