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

45
Patents

203.08588 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.09316 141.1
[M+Na]+ 226.07510 149.4
[M-H]- 202.07860 145.2
[M+NH4]+ 221.11970 158.1
[M+K]+ 242.04904 145.0
[M+H-H2O]+ 186.08314 132.2
[M+HCOO]- 248.08408 165.7
[M+CH3COO]- 262.09973 189.7
[M+Na-2H]- 224.06055 148.8
[M]+ 203.08533 137.1
[M]- 203.08643 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