![4-Isothiazolecarboxylic acid, 5-[[(1,1-dimethylethyl)amino]carbonyl]-3-(1-methylethyl)-](/api/spectrum/Cvu7sFRfRxI/structure.png?h=300&w=458 "4-Isothiazolecarboxylic acid, 5-[[(1,1-dimethylethyl)amino]carbonyl]-3-(1-methylethyl)-")
| SpectraBase Compound ID | atEEodKej0 |
|---|---|
| InChI | InChI=1S/C12H18N2O3S/c1-6(2)8-7(11(16)17)9(18-14-8)10(15)13-12(3,4)5/h6H,1-5H3,(H,13,15)(H,16,17) |
| InChIKey | MSYALLANDNOMDG-UHFFFAOYSA-N |
| Mol Weight | 270.35 g/mol |
| Molecular Formula | C12H18N2O3S |
| Exact Mass | 270.103814 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | Cvu7sFRfRxI |
|---|---|
| Name | 4-Isothiazolecarboxylic acid, 5-[[(1,1-dimethylethyl)amino]carbonyl]-3-(1-methylethyl)- |
| CAS Registry Number | 126242-82-8 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H18N2O3S |
| InChI | InChI=1S/C12H18N2O3S/c1-6(2)8-7(11(16)17)9(18-14-8)10(15)13-12(3,4)5/h6H,1-5H3,(H,13,15)(H,16,17) |
| InChIKey | MSYALLANDNOMDG-UHFFFAOYSA-N |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |