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
2
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]+ 316.107616 170.2
[M+Na]+ 338.089558 179.1
[M-H]- 314.093064 173.6
[M+NH4]+ 333.134163 182.6
[M+K]+ 354.063498 172.7
[M+H-H2O]+ 298.097600 158.0
[M+HCOO]- 360.098541 187.7
[M+CH3COO]- 374.114191 180.6
[M+Na-2H]- 336.075006 174.1
[M]+ 315.09979142 168.1
[M]- 315.10088858 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.