CID 10608925

5-bromo-2-chlorobenzaldehyde

Structural Information

Molecular Formula
C7H4BrClO
SMILES
C1=CC(=C(C=C1Br)C=O)Cl
InChI
InChI=1S/C7H4BrClO/c8-6-1-2-7(9)5(3-6)4-10/h1-4H
InChIKey
DPKKRQAEYWOISP-UHFFFAOYSA-N
Compound name
5-bromo-2-chlorobenzaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

589
Patents

217.9134 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.92068 132.7
[M+Na]+ 240.90262 138.5
[M+NH4]+ 235.94722 138.7
[M+K]+ 256.87656 137.1
[M-H]- 216.90612 133.9
[M+Na-2H]- 238.88807 137.7
[M]+ 217.91285 133.0
[M]- 217.91395 133.0
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