| SpectraBase Compound ID | 9RqyjgglUtH |
|---|---|
| InChI | InChI=1S/C12H16O4S/c1-3-4-8(13)11-9(14)5-7(6-10(11)15)12(16)17-2/h7,14H,3-6H2,1-2H3 |
| InChIKey | AGRIMNFYEQHBMD-UHFFFAOYSA-N |
| Mol Weight | 256.32 g/mol |
| Molecular Formula | C12H16O4S |
| Exact Mass | 256.07693 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | KAIr1wQlm15 |
|---|---|
| Name | 3-Cyclohexene-1-carbothioic acid, 3-hydroxy-5-oxo-4-(1-oxobutyl)-,S-methyl ester |
| CAS Registry Number | 120074-05-7 |
| Copyright | Copyright © 1989, 1990-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C12H16O4S |
| InChI | InChI=1S/C12H16O4S/c1-3-4-8(13)11-9(14)5-7(6-10(11)15)12(16)17-2/h7,14H,3-6H2,1-2H3 |
| InChIKey | AGRIMNFYEQHBMD-UHFFFAOYSA-N |
| Instrument Name | Bruker IFS 88 C |
| Technique | KBr-Pellet |