CID 72212805

6-bromo-5-chloronicotinaldehyde

Structural Information

Molecular Formula
C6H3BrClNO
SMILES
C1=C(C=NC(=C1Cl)Br)C=O
InChI
InChI=1S/C6H3BrClNO/c7-6-5(8)1-4(3-10)2-9-6/h1-3H
InChIKey
ZHMQXDVVKJUUBH-UHFFFAOYSA-N
Compound name
6-bromo-5-chloropyridine-3-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

218.90865 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.91593 133.2
[M+Na]+ 241.89787 138.8
[M+NH4]+ 236.94247 138.6
[M+K]+ 257.87181 137.9
[M-H]- 217.90137 133.6
[M+Na-2H]- 239.88332 137.9
[M]+ 218.90810 133.2
[M]- 218.90920 133.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.