| SpectraBase Compound ID | HB2n6Ml9cYH |
|---|---|
| InChI | InChI=1S/C18H14ClNO2/c1-20(12-7-3-2-4-8-12)18(22)15-11-16(19)13-9-5-6-10-14(13)17(15)21/h2-11,21H,1H3 |
| InChIKey | KMXDVIYHKSMSJE-UHFFFAOYSA-N |
| Mol Weight | 311.77 g/mol |
| Molecular Formula | C18H14ClNO2 |
| Exact Mass | 311.071306 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JzG9ZMy36hC |
|---|---|
| Name | 2-Naphthalenecarboxamide, 4-chloro-1-hydroxy-N-methyl-N-phenyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 311.071306393 u |
| Formula | C18H14ClNO2 |
| InChI | InChI=1S/C18H14ClNO2/c1-20(12-7-3-2-4-8-12)18(22)15-11-16(19)13-9-5-6-10-14(13)17(15)21/h2-11,21H,1H3 |
| InChIKey | KMXDVIYHKSMSJE-UHFFFAOYSA-N |
| Molecular Weight | 311.768 g/mol |
| SMILES | CN(C(=O)C1=CC(Cl)=C2C(=C1O)C=CC=C2)C1=CC=CC=C1 |