![4-Isothiazolecarboxylic acid, 3-(1-methylethyl)-5-[[(1-methylethyl)amino]carbonyl]-](/api/spectrum/7aYoIjZxioe/structure.png?h=300&w=458 "4-Isothiazolecarboxylic acid, 3-(1-methylethyl)-5-[[(1-methylethyl)amino]carbonyl]-")
| SpectraBase Compound ID | 2TxCbLmC0n4 |
|---|---|
| InChI | InChI=1S/C11H16N2O3S/c1-5(2)8-7(11(15)16)9(17-13-8)10(14)12-6(3)4/h5-6H,1-4H3,(H,12,14)(H,15,16) |
| InChIKey | DJMZMMPKJJQZRX-UHFFFAOYSA-N |
| Mol Weight | 256.32 g/mol |
| Molecular Formula | C11H16N2O3S |
| Exact Mass | 256.088164 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 7aYoIjZxioe |
|---|---|
| Name | 4-Isothiazolecarboxylic acid, 3-(1-methylethyl)-5-[[(1-methylethyl)amino]carbonyl]- |
| CAS Registry Number | 126242-80-6 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C11H16N2O3S |
| InChI | InChI=1S/C11H16N2O3S/c1-5(2)8-7(11(15)16)9(17-13-8)10(14)12-6(3)4/h5-6H,1-4H3,(H,12,14)(H,15,16) |
| InChIKey | DJMZMMPKJJQZRX-UHFFFAOYSA-N |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |