| 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 |
15N Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3CkDT8Dbdfv |
|---|---|
| Name | 3-Chloro-aniline |
| CAS Registry Number | 108-42-9 |
| Comments | DMSO COND.F.1HCOUPL-CONST:CDCL3 COND.F.13CCOUPL.CONST:DMSO.D6 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. 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 |
| Literature Reference | T. Axenrod et. al., J. Am. Chem. Soc. 93, 6536 (1971). |
| NMR Standard | CH3NO2 |
| Observed nucleus | 15N |