SpectraBase Compound ID | 7UVQsizcwGz |
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InChI | InChI=1S/C13H7Cl5S/c1-19-12-3-6(2-11(17)13(12)18)7-4-9(15)10(16)5-8(7)14/h2-5H,1H3 |
InChIKey | CVNXAMVLUKWXGQ-UHFFFAOYSA-N |
Mol Weight | 372.5 g/mol |
Molecular Formula | C13H7Cl5S |
Exact Mass | 369.87111 g/mol |
SpectraBase Spectrum ID | JCLXhtPXjoZ |
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Name | 5'-(Methylthio)-2,3',4,4',5-pentachlorobiphenyl |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C13H7Cl5S |
InChI | InChI=1S/C13H7Cl5S/c1-19-12-3-6(2-11(17)13(12)18)7-4-9(15)10(16)5-8(7)14/h2-5H,1H3 |
InChIKey | CVNXAMVLUKWXGQ-UHFFFAOYSA-N |
Molecular Weight | 372.524 g/mol |
SMILES | c1(-c2c(cc(c(c2)Cl)Cl)Cl)cc(SC)c(c(c1)Cl)Cl |
SPLASH | splash10-00di-0009000000-3e0c6fbd5b69cff8f425 |
Source of Spectrum | CRT-11-1509-E |
Wiley ID | 1709746 |