heptyl 3-bromo-5-(chlorosulfonyl)benzoate
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Basic information
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Exact Mass | 395.97977 |
Smiles | O=C(OCCCCCCC)C1=CC(S(=O)(Cl)=O)=CC(Br)=C1 |
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Canonical Smiles | CCCCCCCOC(=O)C1=CC(=CC(Br)=C1)S(=O)(=O)Cl |
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Inchi | InChI=1S/C14H18BrClO4S/c1-2-3-4-5-6-7-20-14(17)11-8-12(15)10-13(9-11)21(16,18)19/h8-10H,2-7H2,1H3 |
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InchiKey | AARXBAJHVBJFGV-UHFFFAOYSA-N |
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