CID 55278227

1391351-76-0

Structural Information

Molecular Formula
C7H9FN2
SMILES
C[C@H](C1=C(N=CC=C1)F)N
InChI
InChI=1S/C7H9FN2/c1-5(9)6-3-2-4-10-7(6)8/h2-5H,9H2,1H3/t5-/m1/s1
InChIKey
OKPDARBMBAKIOO-RXMQYKEDSA-N
Compound name
(1R)-1-(2-fluoropyridin-3-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

140.07498 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.08226 126.7
[M+Na]+ 163.06420 138.2
[M+NH4]+ 158.10880 134.8
[M+K]+ 179.03814 132.6
[M-H]- 139.06770 127.6
[M+Na-2H]- 161.04965 133.4
[M]+ 140.07443 128.4
[M]- 140.07553 128.4
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

patents stripe