CID 2763160

329794-28-7

Structural Information

Molecular Formula
C6H3ClFNO
SMILES
C1=CN=C(C(=C1C=O)F)Cl
InChI
InChI=1S/C6H3ClFNO/c7-6-5(8)4(3-10)1-2-9-6/h1-3H
InChIKey
RWSUDYQQHLWWDK-UHFFFAOYSA-N
Compound name
2-chloro-3-fluoropyridine-4-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

240
Patents

158.98872 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.99600 124.8
[M+Na]+ 181.97794 139.2
[M+NH4]+ 177.02254 133.3
[M+K]+ 197.95188 132.2
[M-H]- 157.98144 125.3
[M+Na-2H]- 179.96339 132.3
[M]+ 158.98817 127.2
[M]- 158.98927 127.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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