CID 137952298

2-chloro-3-fluoro-5-iodopyridine-4-carbaldehyde

Structural Information

Molecular Formula
C6H2ClFINO
SMILES
C1=C(C(=C(C(=N1)Cl)F)C=O)I
InChI
InChI=1S/C6H2ClFINO/c7-6-5(8)3(2-11)4(9)1-10-6/h1-2H
InChIKey
XMJLJGFQOLKLAP-UHFFFAOYSA-N
Compound name
2-chloro-3-fluoro-5-iodopyridine-4-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.88538 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.89266 130.9
[M+Na]+ 307.87460 136.0
[M-H]- 283.87810 125.9
[M+NH4]+ 302.91920 146.4
[M+K]+ 323.84854 138.0
[M+H-H2O]+ 267.88264 121.7
[M+HCOO]- 329.88358 145.0
[M+CH3COO]- 343.89923 187.5
[M+Na-2H]- 305.86005 125.8
[M]+ 284.88483 130.5
[M]- 284.88593 130.5
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.