![4-Isothiazolecarboxylic acid, 3-methyl-5-[[(1-methylethyl)amino]carbonyl]-](/api/spectrum/7r9SyF5kc4C/structure.png?h=300&w=458 "4-Isothiazolecarboxylic acid, 3-methyl-5-[[(1-methylethyl)amino]carbonyl]-")
| SpectraBase Compound ID | CtZyrkdPbkG |
|---|---|
| InChI | InChI=1S/C9H12N2O3S/c1-4(2)10-8(12)7-6(9(13)14)5(3)11-15-7/h4H,1-3H3,(H,10,12)(H,13,14) |
| InChIKey | LPCLAAPREQPMKG-UHFFFAOYSA-N |
| Mol Weight | 228.27 g/mol |
| Molecular Formula | C9H12N2O3S |
| Exact Mass | 228.056863 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 7r9SyF5kc4C |
|---|---|
| Name | 4-Isothiazolecarboxylic acid, 3-methyl-5-[[(1-methylethyl)amino]carbonyl]- |
| CAS Registry Number | 126242-65-7 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H12N2O3S |
| InChI | InChI=1S/C9H12N2O3S/c1-4(2)10-8(12)7-6(9(13)14)5(3)11-15-7/h4H,1-3H3,(H,10,12)(H,13,14) |
| InChIKey | LPCLAAPREQPMKG-UHFFFAOYSA-N |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |