| SpectraBase Compound ID | BKNPdITKs6y |
|---|---|
| InChI | InChI=1S/C10H9N.C3H5ClO2/c11-10-7-3-5-8-4-1-2-6-9(8)10;1-2(4)3(5)6/h1-7H,11H2;2H,1H3,(H,5,6) |
| InChIKey | TWNCTWABIARSJY-UHFFFAOYSA-N |
| Mol Weight | 251.71 g/mol |
| Molecular Formula | C13H14ClNO2 |
| Exact Mass | 251.071306 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BvQlvtsDqiT |
|---|---|
| Name | 1-Naphthylamine, 2-chloropropionate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 251.071306393 u |
| Formula | C13H14ClNO2 |
| InChI | InChI=1S/C10H9N.C3H5ClO2/c11-10-7-3-5-8-4-1-2-6-9(8)10;1-2(4)3(5)6/h1-7H,11H2;2H,1H3,(H,5,6) |
| InChIKey | TWNCTWABIARSJY-UHFFFAOYSA-N |
| Molecular Weight | 251.713 g/mol |
| Nominal Mass | 251 u |
| SMILES | OC(C(C)Cl)=O.NC1=CC=CC=2C=CC=CC12 |