| SpectraBase Compound ID | IXKtxpNPaRa |
|---|---|
| InChI | InChI=1S/C4H2N2S/c5-1-4-2-6-7-3-4/h2-3H |
| InChIKey | OCYPFRDEUKBLNI-UHFFFAOYSA-N |
| Mol Weight | 110.13 g/mol |
| Molecular Formula | C4H2N2S |
| Exact Mass | 109.993869 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LNjG5G3KfFJ |
|---|---|
| Name | 4-Cyanoisothiazole |
| CAS Registry Number | 3912-37-6 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C4H2N2S |
| InChI | InChI=1S/C4H2N2S/c5-1-4-2-6-7-3-4/h2-3H |
| InChIKey | OCYPFRDEUKBLNI-UHFFFAOYSA-N |
| Literature Reference | Can. J. Chem. 53, 1677 (1975). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | Acetone-D6 |