CID 10679649

4-n-(4-fluorophenyl)pyridine-3,4-diamine

Structural Information

Molecular Formula
C11H10FN3
SMILES
C1=CC(=CC=C1NC2=C(C=NC=C2)N)F
InChI
InChI=1S/C11H10FN3/c12-8-1-3-9(4-2-8)15-11-5-6-14-7-10(11)13/h1-7H,13H2,(H,14,15)
InChIKey
YWFXJNSRFLGLHP-UHFFFAOYSA-N
Compound name
4-N-(4-fluorophenyl)pyridine-3,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

31
Patents

203.08588 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.093156 141.1
[M+Na]+ 226.075098 149.4
[M-H]- 202.078604 145.2
[M+NH4]+ 221.119703 158.1
[M+K]+ 242.049038 145.0
[M+H-H2O]+ 186.083140 132.2
[M+HCOO]- 248.084081 165.7
[M+CH3COO]- 262.099731 189.7
[M+Na-2H]- 224.060546 148.8
[M]+ 203.08533142 137.1
[M]- 203.08642858 137.1
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

patents stripe