CID 43144922

[3-fluoro-4-(pyridin-3-yloxy)phenyl]methanamine

Structural Information

Molecular Formula
C12H11FN2O
SMILES
C1=CC(=CN=C1)OC2=C(C=C(C=C2)CN)F
InChI
InChI=1S/C12H11FN2O/c13-11-6-9(7-14)3-4-12(11)16-10-2-1-5-15-8-10/h1-6,8H,7,14H2
InChIKey
JMUZAAYESOWFSI-UHFFFAOYSA-N
Compound name
(3-fluoro-4-pyridin-3-yloxyphenyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

218.08554 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.09282 146.7
[M+Na]+ 241.07476 160.5
[M+NH4]+ 236.11936 154.7
[M+K]+ 257.04870 153.0
[M-H]- 217.07826 150.1
[M+Na-2H]- 239.06021 155.9
[M]+ 218.08499 149.5
[M]- 218.08609 149.5
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.