| SpectraBase Spectrum ID |
JpTO0dWhCAM |
| Name |
Iberin |
| Alternate Name(s) |
3-(Methylsulphinyl)propylisothiocyanate
1-Isothiocyanato-3-methylsulfinyl-propane
3-Isothiocyanatopropyl methyl sulfoxide
Isothiocyanic acid, 3-(methylsulfinyl)propyl ester
3-Methylsulphinylpropylisothiocyanate
Propane, 1-isothiocyanato-3-(methylsulfinyl)-
1-Isothiocyanato-3-(methylsulfinyl)propane
1-Isothiocyanato-3-methylsulfinylpropane |
| CAS Registry Number |
505-44-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C5H9NOS2 |
| InChI |
InChI=1S/C5H9NOS2/c1-9(7)4-2-3-6-5-8/h2-4H2,1H3 |
| InChIKey |
LELAOEBVZLPXAZ-UHFFFAOYSA-N |
| Molecular Weight |
163.253 g/mol |
| SMILES |
C(CCS(=O)C)N=C=S |
| SPLASH |
splash10-00di-9400000000-8fc61cee08c68b0b8321 |
| Source of Spectrum |
QC-6-1573-1 |
| Wiley ID |
868867 |
