CID 58532395

3-fluoro-5-methylpicolinaldehyde

Structural Information

Molecular Formula
C7H6FNO
SMILES
CC1=CC(=C(N=C1)C=O)F
InChI
InChI=1S/C7H6FNO/c1-5-2-6(8)7(4-10)9-3-5/h2-4H,1H3
InChIKey
VYEHORMIEVYVPA-UHFFFAOYSA-N
Compound name
3-fluoro-5-methylpyridine-2-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

139.04333 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.05061 125.8
[M+Na]+ 162.03255 139.2
[M+NH4]+ 157.07715 133.8
[M+K]+ 178.00649 132.7
[M-H]- 138.03605 126.2
[M+Na-2H]- 160.01800 132.8
[M]+ 139.04278 127.7
[M]- 139.04388 127.7
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