CID 9578561

24050-99-5

Structural Information

Molecular Formula
C16H11FN2S
SMILES
C1=CC=C(C=C1)C2=CSC(=N2)/N=C/C3=CC=C(C=C3)F
InChI
InChI=1S/C16H11FN2S/c17-14-8-6-12(7-9-14)10-18-16-19-15(11-20-16)13-4-2-1-3-5-13/h1-11H/b18-10+
InChIKey
UVXFNFYOQFXODC-VCHYOVAHSA-N
Compound name
(E)-1-(4-fluorophenyl)-N-(4-phenyl-1,3-thiazol-2-yl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

282.06268 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.06996 161.2
[M+Na]+ 305.05190 171.2
[M-H]- 281.05540 170.5
[M+NH4]+ 300.09650 178.6
[M+K]+ 321.02584 164.9
[M+H-H2O]+ 265.05994 151.8
[M+HCOO]- 327.06088 182.7
[M+CH3COO]- 341.07653 174.1
[M+Na-2H]- 303.03735 163.9
[M]+ 282.06213 162.4
[M]- 282.06323 162.4
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.