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Octhilinone-d17

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For Research Use Only | Not For Clinical Use
CATAPS1185109798
CAS1185109-79-8
SynonymsPancil-D17, SD 888-d17, Skane 8-d17, RH 893-d17, 2-Octyl-3(2H)-isothiazolone-d17, Kathon-d17,2-Octyl-4-isothiazolin-3-one-d17
IUPAC Name2-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecadeuteriooctyl)isothiazol-3-one
Molecular Weight230.44
Molecular FormulaC11D17H2NOS
Canonical SMILES[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])N1SC=CC1=O
InChIInChI=1S/C11H19NOS/c1-2-3-4-5-6-7-9-12-11(13)8-10-14-12/h8,10H,2-7,9H2,1H3/i1D3,2D2,3D2,4D2,5D2,6D2,7D2,9D2
Accurate Mass230.2254
FormatNeat
SubcategoryFungicides and metabolites, Stable isotope labelled compounds
TypeStable Isotope Labelled
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