CID 46315157

1060809-18-8

Structural Information

Molecular Formula
C6H4FNO
SMILES
C1=CN=C(C=C1F)C=O
InChI
InChI=1S/C6H4FNO/c7-5-1-2-8-6(3-5)4-9/h1-4H
InChIKey
WRKFEQUUQYBTPF-UHFFFAOYSA-N
Compound name
4-fluoropyridine-2-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

49
Patents

125.027695 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.03497 118.1
[M+Na]+ 148.01691 128.1
[M-H]- 124.02042 119.7
[M+NH4]+ 143.06152 139.2
[M+K]+ 163.99085 126.5
[M+H-H2O]+ 108.02496 111.5
[M+HCOO]- 170.02590 141.8
[M+CH3COO]- 184.04155 169.8
[M+Na-2H]- 146.00236 126.9
[M]+ 125.02715 117.5
[M]- 125.02824 117.5
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

patents stripe