| SpectraBase Compound ID | ARrSXXzdR3r |
|---|---|
| InChI | InChI=1S/C14H12O3/c1-9(15)14-12-6-4-3-5-11(12)7-8-13(14)17-10(2)16/h3-8H,1-2H3 |
| InChIKey | XMSGQSPGLLJKPQ-UHFFFAOYSA-N |
| Mol Weight | 228.25 g/mol |
| Molecular Formula | C14H12O3 |
| Exact Mass | 228.078644 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LRybalhJZJh |
|---|---|
| Name | Acetic acid, 1-acetyl-2-naphthalenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 228.078644243 u |
| Formula | C14H12O3 |
| InChI | InChI=1S/C14H12O3/c1-9(15)14-12-6-4-3-5-11(12)7-8-13(14)17-10(2)16/h3-8H,1-2H3 |
| InChIKey | XMSGQSPGLLJKPQ-UHFFFAOYSA-N |
| Molecular Weight | 228.247 g/mol |
| SMILES | C1=CC=CC2=C1C(=C(C=C2)OC(C)=O)C(=O)C |