| SpectraBase Compound ID | 6fWOF7Epb2A |
|---|---|
| InChI | InChI=1S/C6H6ClN/c7-5-2-1-3-6(8)4-5/h1-4H,8H2 |
| InChIKey | PNPCRKVUWYDDST-UHFFFAOYSA-N |
| Mol Weight | 127.57 g/mol |
| Molecular Formula | C6H6ClN |
| Exact Mass | 127.018877 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CycaJZKPsdP |
|---|---|
| Name | 3-Chloroaniline |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H6ClN |
| InChI | InChI=1S/C6H6ClN/c7-5-2-1-3-6(8)4-5/h1-4H,8H2 |
| InChIKey | PNPCRKVUWYDDST-UHFFFAOYSA-N |
| Instrument Name | Agilent 6890-5973N |
| Ionization Type | EI |
| Literature Reference DOI | 10.1002/adsc.202000127 |
| Molecular Weight | 127.574 g/mol |
| SMILES | Nc1cccc(c1)Cl |
| SPLASH | splash10-004i-8900000000-8a1b5fc337a707df7973 |
| Source of Spectrum | ASC-362-SM34-3n |
| Wiley ID | 1839311 |