CID 16723172

Sulfoxaflor

Structural Information

Molecular Formula
C10H10F3N3OS
SMILES
CC(C1=CN=C(C=C1)C(F)(F)F)S(=NC#N)(=O)C
InChI
InChI=1S/C10H10F3N3OS/c1-7(18(2,17)16-6-14)8-3-4-9(15-5-8)10(11,12)13/h3-5,7H,1-2H3
InChIKey
ZVQOOHYFBIDMTQ-UHFFFAOYSA-N
Compound name
[methyl-oxo-[1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]-lambda6-sulfanylidene]cyanamide
Related CIDs

2D Structure

compound 2d structure
8
Annotation Hits

177
References

33439
Patents

277.04968 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.05696 160.5
[M+Na]+ 300.03890 170.1
[M-H]- 276.04240 160.4
[M+NH4]+ 295.08350 174.3
[M+K]+ 316.01284 167.6
[M+H-H2O]+ 260.04694 144.7
[M+HCOO]- 322.04788 170.8
[M+CH3COO]- 336.06353 209.7
[M+Na-2H]- 298.02435 162.9
[M]+ 277.04913 154.1
[M]- 277.05023 154.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.