| SpectraBase Compound ID | G8xekUBZBdg |
|---|---|
| InChI | InChI=1S/C13H17ClO3S2/c1-18-11-7-8(13(17)19-2)6-10(16)12(11)9(15)4-3-5-14/h8H,3-7H2,1-2H3 |
| InChIKey | VSDUGFFQOLJRSA-UHFFFAOYSA-N |
| Mol Weight | 320.85 g/mol |
| Molecular Formula | C13H17ClO3S2 |
| Exact Mass | 320.030764 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | GvWcgO3J5m8 |
|---|---|
| Name | 3-Cyclohexene-1-carbothioic acid, 4-(4-chloro-1-oxobutyl)-3-(methylthio)-5-oxo-, S-methyl ester |
| CAS Registry Number | 120074-31-9 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C13H17ClO3S2 |
| InChI | InChI=1S/C13H17ClO3S2/c1-18-11-7-8(13(17)19-2)6-10(16)12(11)9(15)4-3-5-14/h8H,3-7H2,1-2H3 |
| InChIKey | VSDUGFFQOLJRSA-UHFFFAOYSA-N |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |