| SpectraBase Compound ID | KWx61bhnWbH |
|---|---|
| InChI | InChI=1S/C7H3ClN2O2/c8-6-2-1-5(4-9)3-7(6)10(11)12/h1-3H |
| InChIKey | XBLPHYSLHRGMNW-UHFFFAOYSA-N |
| Mol Weight | 182.57 g/mol |
| Molecular Formula | C7H3ClN2O2 |
| Exact Mass | 181.988305 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2ggmC7YbKAt |
|---|---|
| Name | 4-CHLORO-3-NITROBENZONITRILE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H3ClN2O2 |
| InChI | InChI=1S/C7H3ClN2O2/c8-6-2-1-5(4-9)3-7(6)10(11)12/h1-3H |
| InChIKey | XBLPHYSLHRGMNW-UHFFFAOYSA-N |
| Molecular Weight | 181.9883 |
| SMILES | c1(Cl)c(N(=O)=O)cc(C#N)cc1 |
| SPLASH | splash10-0f8i-5900000000-0d6e939e3af7bfa810dc |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |