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Quetiapine-d8 Fumarate

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For Research Use Only | Not For Clinical Use
CATAPS1185247124
CAS1185247-12-4
Structure
SynonymsQuetiapine-D8 hemifumarate
IUPAC Name2-[2-(4-benzo[b][1,4]benzothiazepin-6-yl-2,2,3,3,5,5,6,6-octadeuteriopiperazin-1-yl)ethoxy]ethanol;(E)-but-2-enedioic acid
Molecular Weight899.18
Molecular Formula2C212H8H17N3O2S.C4H4O4
Canonical SMILES[2H]C1([2H])N(CCOCCO)C([2H])([2H])C([2H])([2H])N(C2=Nc3ccccc3Sc4ccccc24)C1([2H])[2H].[2H]C5([2H])N(CCOCCO)C([2H])([2H])C([2H])([2H])N(C6=Nc7ccccc7Sc8ccccc68)C5([2H])[2H].OC(=O)\C=C\C(=O)O
InChIInChI=1S/2C21H25N3O2S.C4H4O4/c2*25-14-16-26-15-13-23-9-11-24(12-10-23)21-17-5-1-3-7-19(17)27-20-8-4-2-6-18(20)22-21
Accurate Mass898.4449
FormatNeat
Product TypeStable Isotope Labelled
SubcategoryAntipsychotics, Stable isotope labelled compounds, Pharmaceutical
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CATSizeShippingStorage Conditions
APS1185247124-10MG 10MG Room Temperature Inquiry
APS1185247124-1MG 1MG Room Temperature 2-8°C Fridge/Coldroom Inquiry
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