![4-Isothiazolecarboxylic acid, 3-(1-methylethyl)-5-[[(1-methylethyl)amino]carbonyl]-, methyl ester](/api/spectrum/FjUZWKZfJXR/structure.png?h=300&w=458 "4-Isothiazolecarboxylic acid, 3-(1-methylethyl)-5-[[(1-methylethyl)amino]carbonyl]-, methyl ester")
| SpectraBase Compound ID | 6nV30r14GIa |
|---|---|
| InChI | InChI=1S/C12H18N2O3S/c1-6(2)9-8(12(16)17-5)10(18-14-9)11(15)13-7(3)4/h6-7H,1-5H3,(H,13,15) |
| InChIKey | HOVPGSCCDBQTMV-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 | FjUZWKZfJXR |
|---|---|
| Name | 4-Isothiazolecarboxylic acid, 3-(1-methylethyl)-5-[[(1-methylethyl)amino]carbonyl]-, methyl ester |
| CAS Registry Number | 126242-81-7 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H18N2O3S |
| InChI | InChI=1S/C12H18N2O3S/c1-6(2)9-8(12(16)17-5)10(18-14-9)11(15)13-7(3)4/h6-7H,1-5H3,(H,13,15) |
| InChIKey | HOVPGSCCDBQTMV-UHFFFAOYSA-N |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |