| SpectraBase Compound ID | LKANon4gHir |
|---|---|
| InChI | InChI=1S/C7H5NO2S/c1-10-7(9)6-4-11-3-5(6)2-8/h3-4H,1H3 |
| InChIKey | OYLLMMDSPYTFPP-UHFFFAOYSA-N |
| Mol Weight | 167.18 g/mol |
| Molecular Formula | C7H5NO2S |
| Exact Mass | 167.0041 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 3mnebteK2H4 |
|---|---|
| Name | 3-Thiophenecarboxylic acid, 4-cyano-, methyl ester |
| CAS Registry Number | 67808-36-0 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H5NO2S |
| InChI | InChI=1S/C7H5NO2S/c1-10-7(9)6-4-11-3-5(6)2-8/h3-4H,1H3 |
| InChIKey | OYLLMMDSPYTFPP-UHFFFAOYSA-N |
| Instrument Name | Bruker IFS 85 |
| Purity | slightly contaminated |
| Synonyms | 4-Cyano-thiophene-3-carboxylic acid, methyl ester |
| Technique | KBr-Pellet |