![5-Chloro-2-[3-(N-dimethylamino)-1-oxopropyl]phenol](/api/spectrum/LNVTbo58q8T/structure.png?h=300&w=458 "5-Chloro-2-[3-(N-dimethylamino)-1-oxopropyl]phenol")
| SpectraBase Compound ID | 1VXHRNNWErt |
|---|---|
| InChI | InChI=1S/C11H14ClNO2/c1-13(2)6-5-10(14)9-4-3-8(12)7-11(9)15/h3-4,7,15H,5-6H2,1-2H3 |
| InChIKey | JPROVMAINUVATJ-UHFFFAOYSA-N |
| Mol Weight | 227.69 g/mol |
| Molecular Formula | C11H14ClNO2 |
| Exact Mass | 227.071306 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LNVTbo58q8T |
|---|---|
| Name | 5-Chloro-2-[3-(N-dimethylamino)-1-oxopropyl]phenol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 227.071306393 u |
| Formula | C11H14ClNO2 |
| InChI | InChI=1S/C11H14ClNO2/c1-13(2)6-5-10(14)9-4-3-8(12)7-11(9)15/h3-4,7,15H,5-6H2,1-2H3 |
| InChIKey | JPROVMAINUVATJ-UHFFFAOYSA-N |
| Molecular Weight | 227.691 g/mol |
| SMILES | C1(=C(C=C(C=C1)Cl)O)C(CCN(C)C)=O |