CID 155977707

[(5-bromo-2-chloropyridin-4-yl)methyl](methyl)amine

Structural Information

Molecular Formula
C7H8BrClN2
SMILES
CNCC1=CC(=NC=C1Br)Cl
InChI
InChI=1S/C7H8BrClN2/c1-10-3-5-2-7(9)11-4-6(5)8/h2,4,10H,3H2,1H3
InChIKey
HMWAUDJBMYQZMH-UHFFFAOYSA-N
Compound name
1-(5-bromo-2-chloropyridin-4-yl)-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

233.95593 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.96321 137.2
[M+Na]+ 256.94515 150.5
[M-H]- 232.94865 142.5
[M+NH4]+ 251.98975 158.5
[M+K]+ 272.91909 137.5
[M+H-H2O]+ 216.95319 137.3
[M+HCOO]- 278.95413 155.1
[M+CH3COO]- 292.96978 188.9
[M+Na-2H]- 254.93060 146.0
[M]+ 233.95538 157.2
[M]- 233.95648 157.2
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.