CID 211757

23564-72-9

Structural Information

Molecular Formula
C13H10ClFN2
SMILES
C1=CC=C(C(=C1)C(=NC2=CC(=CC=C2)F)N)Cl
InChI
InChI=1S/C13H10ClFN2/c14-12-7-2-1-6-11(12)13(16)17-10-5-3-4-9(15)8-10/h1-8H,(H2,16,17)
InChIKey
ALGLYDTUESCZAQ-UHFFFAOYSA-N
Compound name
2-chloro-N'-(3-fluorophenyl)benzenecarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

248.05165 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.05893 152.8
[M+Na]+ 271.04087 161.5
[M-H]- 247.04437 159.2
[M+NH4]+ 266.08547 170.7
[M+K]+ 287.01481 155.7
[M+H-H2O]+ 231.04891 145.1
[M+HCOO]- 293.04985 174.0
[M+CH3COO]- 307.06550 198.7
[M+Na-2H]- 269.02632 157.7
[M]+ 248.05110 151.6
[M]- 248.05220 151.6
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.