CID 11693262

Bis(4-fluorophenyl)methyl(4h-1,2,4-triazol-4yl-methyl)silane

Structural Information

Molecular Formula
C16H15F2N3Si
SMILES
C[Si](CN1C=NN=C1)(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F
InChI
InChI=1S/C16H15F2N3Si/c1-22(12-21-10-19-20-11-21,15-6-2-13(17)3-7-15)16-8-4-14(18)5-9-16/h2-11H,12H2,1H3
InChIKey
UHFBTGZSQCBFKK-UHFFFAOYSA-N
Compound name
bis(4-fluorophenyl)-methyl-(1,2,4-triazol-4-ylmethyl)silane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

315.10034 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.10762 170.2
[M+Na]+ 338.08956 179.1
[M-H]- 314.09306 173.6
[M+NH4]+ 333.13416 182.6
[M+K]+ 354.06350 172.7
[M+H-H2O]+ 298.09760 158.0
[M+HCOO]- 360.09854 187.7
[M+CH3COO]- 374.11419 180.6
[M+Na-2H]- 336.07501 174.1
[M]+ 315.09979 168.1
[M]- 315.10089 168.1
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.