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Reference substances

Reference substances

IUPAC name:
2-(4-bromo-2,6-difluorophenyl)-3,4,5,6-tetrahydropyrimidin-1-ium trifluoromethanesulfonate

Inventory

CAS number:
511540-63-9
Synonyms
Names:
2-(4-Brom-2,6-difluorphenyl)-4H-1,3-dithiin-1-iumtrifluormethansulfonat

Molecular and structural information

Molecular formula:
C10H8BrF2S2.CF3O3S
Molecular weight:
459.27
SMILES notation:
O=S(=O)([O-])C(F)(F)F.FC1=CC(Br)=CC(F)=C1C=2SCCC[S+]2
InChl:
1S/C10H8BrF2S2.CHF3O3S/c11-6-4-7(12)9(8(13)5-6)10-14-2-1-3-15-10;2-1(3,4)8(5,6)7/h4-5H,1-3H2;(H,5,6,7)/q+1;/p-1
Structural formula:
Chemical structure

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