| SpectraBase Compound ID | 2E0dLd2PjtX |
|---|---|
| InChI | InChI=1S/C22H16O4/c1-13(23)25-19-11-12-20(26-14(2)24)22-18-10-6-4-8-16(18)15-7-3-5-9-17(15)21(19)22/h3-12H,1-2H3 |
| InChIKey | IYBBBCUVWJNLKT-UHFFFAOYSA-N |
| Mol Weight | 344.37 g/mol |
| Molecular Formula | C22H16O4 |
| Exact Mass | 344.104859 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JF7iXUXWzxT |
|---|---|
| Name | (4-Acetoxytriphenylen-1-yl) acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 344.104858991 u |
| Formula | C22H16O4 |
| InChI | InChI=1S/C22H16O4/c1-13(23)25-19-11-12-20(26-14(2)24)22-18-10-6-4-8-16(18)15-7-3-5-9-17(15)21(19)22/h3-12H,1-2H3 |
| InChIKey | IYBBBCUVWJNLKT-UHFFFAOYSA-N |
| Molecular Weight | 344.366 g/mol |
| SMILES | C=12C(C3=CC=CC=C3C=3C2=CC=CC3)=C(OC(=O)C)C=CC1OC(=O)C |