![N-[3'-Chlorobenzoyl]pyrrole](/api/spectrum/Cmszrr0tXPj/structure.png?h=300&w=458 "N-[3'-Chlorobenzoyl]pyrrole")
| SpectraBase Compound ID | A8WligH8dic |
|---|---|
| InChI | InChI=1S/C11H8ClNO/c12-10-5-3-4-9(8-10)11(14)13-6-1-2-7-13/h1-8H |
| InChIKey | NPADQUMIRQICFT-UHFFFAOYSA-N |
| Mol Weight | 205.64 g/mol |
| Molecular Formula | C11H8ClNO |
| Exact Mass | 205.029442 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Cmszrr0tXPj |
|---|---|
| Name | N-[3'-Chlorobenzoyl]pyrrole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 205.029441581 u |
| Formula | C11H8ClNO |
| InChI | InChI=1S/C11H8ClNO/c12-10-5-3-4-9(8-10)11(14)13-6-1-2-7-13/h1-8H |
| InChIKey | NPADQUMIRQICFT-UHFFFAOYSA-N |
| Molecular Weight | 205.644 g/mol |
| SMILES | C(N1C=CC=C1)(C=1C=C(Cl)C=CC1)=O |