SpectraBase Compound ID | JiJp7iwVBm4 |
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InChI | InChI=1S/C7H6Cl2O3S/c8-7(9)4(10)3-2(6(11)12)1-13-5(3)7/h2-3,5H,1H2,(H,11,12) |
InChIKey | ASYDEUWTWZVBHS-UHFFFAOYSA-N |
Mol Weight | 241.09 g/mol |
Molecular Formula | C7H6Cl2O3S |
Exact Mass | 239.941471 g/mol |
SpectraBase Spectrum ID | 7o6Lga2whDJ |
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Name | 7,7-Dichloro-2-thiabicyclo[3.2.0]heptan-6-one-4-carboxylic acid |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C7H6Cl2O3S |
InChI | InChI=1S/C7H6Cl2O3S/c8-7(9)4(10)3-2(6(11)12)1-13-5(3)7/h2-3,5H,1H2,(H,11,12) |
InChIKey | ASYDEUWTWZVBHS-UHFFFAOYSA-N |
Molecular Weight | 241.088 g/mol |
SMILES | OC(C1C2C(C(C2=O)(Cl)Cl)SC1)=O |
SPLASH | splash10-0016-5950000000-b8ed546c2b9e04ef5e6a |
Source of Spectrum | J-73-6980-9 |
Wiley ID | 1668625 |