![Spiro[benzofuran-2(3H),1'-cyclohexane]-2',3,4'-trione, 7-chloro-6'-methyl-4,6-bis(methylthio)-](/api/spectrum/IAtOLFtWVHM/structure.png?h=300&w=458 "Spiro[benzofuran-2(3H),1'-cyclohexane]-2',3,4'-trione, 7-chloro-6'-methyl-4,6-bis(methylthio)-")
| SpectraBase Compound ID | 9VctMt1254E |
|---|---|
| InChI | InChI=1S/C16H15ClO4S2/c1-7-4-8(18)5-11(19)16(7)15(20)12-9(22-2)6-10(23-3)13(17)14(12)21-16/h6-7H,4-5H2,1-3H3 |
| InChIKey | NLCRYINPWNQQMN-UHFFFAOYSA-N |
| Mol Weight | 370.87 g/mol |
| Molecular Formula | C16H15ClO4S2 |
| Exact Mass | 370.010029 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IAtOLFtWVHM |
|---|---|
| Name | Spiro[benzofuran-2(3H),1'-cyclohexane]-2',3,4'-trione, 7-chloro-6'-methyl-4,6-bis(methylthio)- |
| CAS Registry Number | 26891-74-7 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H15ClO4S2 |
| InChI | InChI=1S/C16H15ClO4S2/c1-7-4-8(18)5-11(19)16(7)15(20)12-9(22-2)6-10(23-3)13(17)14(12)21-16/h6-7H,4-5H2,1-3H3 |
| InChIKey | NLCRYINPWNQQMN-UHFFFAOYSA-N |
| Molecular Weight | 370.865 g/mol |
| SMILES | CC1CC(CC(C11C(c2c(cc(c(c2O1)Cl)SC)SC)=O)=O)=O |
| SPLASH | splash10-00di-3097000000-35136412467d4a6e19b3 |
| Source of Spectrum | O-2-1167-5 |
| Synonyms | 7-Chloranyl-5'-methyl-4,6-bis(methylsulfanyl)spiro[1-benzofuran-2,4'-cyclohexane]-1',3,3'-trione 7-Chloro-5'-methyl-4,6-bis(methylsulfanyl)spiro[1-benzofuran-2,4'-cyclohexane]-1',3,3'-trione 7-Chloro-5'-methyl-4,6-bis(methylsulfanyl)spiro[benzofuran-2,4'-cyclohexane]-1',3,3'-trione 7-Chloro-5'-methyl-4,6-bis(methylthio)spiro[benzofuran-2,4'-cyclohexane]-1',3,3'-trione 7-Chloro-5'-methyl-4,6-bis(methylthio)spiro[coumaran-2,4'-cyclohexane]-1',3,3'-trione |
| Wiley ID | 1354008 |