| SpectraBase Compound ID | IJWsdGDQaZL |
|---|---|
| InChI | InChI=1S/C16H11NO4/c1-10(18)21-12-8-6-11(7-9-12)17-15(19)13-4-2-3-5-14(13)16(17)20/h2-9H,1H3 |
| InChIKey | OJSGKTLCPVZUFA-UHFFFAOYSA-N |
| Mol Weight | 281.27 g/mol |
| Molecular Formula | C16H11NO4 |
| Exact Mass | 281.068808 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BRTwtI0ut88 |
|---|---|
| Name | 4-(1,3-Dioxoisoindol-2-yl)phenyl acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 281.068807834 u |
| Formula | C16H11NO4 |
| InChI | InChI=1S/C16H11NO4/c1-10(18)21-12-8-6-11(7-9-12)17-15(19)13-4-2-3-5-14(13)16(17)20/h2-9H,1H3 |
| InChIKey | OJSGKTLCPVZUFA-UHFFFAOYSA-N |
| SMILES | C12=CC=CC=C2C(=O)N(C1=O)C1=CC=C(OC(C)=O)C=C1 |