![2-(3-Chloropropyl)benzo[de]isoquinoline-1,3-dione](/api/spectrum/8vQevVxCnuY/structure.png?h=300&w=458 "2-(3-Chloropropyl)benzo[de]isoquinoline-1,3-dione")
| SpectraBase Compound ID | 38gaUy73HS3 |
|---|---|
| InChI | InChI=1S/C15H12ClNO2/c16-8-3-9-17-14(18)11-6-1-4-10-5-2-7-12(13(10)11)15(17)19/h1-2,4-7H,3,8-9H2 |
| InChIKey | CPRJKZMNQLSRAI-UHFFFAOYSA-N |
| Mol Weight | 273.72 g/mol |
| Molecular Formula | C15H12ClNO2 |
| Exact Mass | 273.055656 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8vQevVxCnuY |
|---|---|
| Name | 2-(3-Chloro-propyl)-benzo(de)isoquinoline-1,3-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 273.055656328 u |
| Formula | C15H12ClNO2 |
| InChI | InChI=1S/C15H12ClNO2/c16-8-3-9-17-14(18)11-6-1-4-10-5-2-7-12(13(10)11)15(17)19/h1-2,4-7H,3,8-9H2 |
| InChIKey | CPRJKZMNQLSRAI-UHFFFAOYSA-N |
| SMILES | C12=C3C(N(C(C2=CC=CC1=CC=C3)=O)CCCCl)=O |