CID 59665497

7-bromo-n-methylquinolin-2-amine

Structural Information

Molecular Formula
C10H9BrN2
SMILES
CNC1=NC2=C(C=CC(=C2)Br)C=C1
InChI
InChI=1S/C10H9BrN2/c1-12-10-5-3-7-2-4-8(11)6-9(7)13-10/h2-6H,1H3,(H,12,13)
InChIKey
QEAYLYXHQWVAOF-UHFFFAOYSA-N
Compound name
7-bromo-N-methylquinolin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

58
Patents

235.9949 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.00218 141.2
[M+Na]+ 258.98412 153.4
[M-H]- 234.98762 147.3
[M+NH4]+ 254.02872 162.3
[M+K]+ 274.95806 141.6
[M+H-H2O]+ 218.99216 140.5
[M+HCOO]- 280.99310 162.5
[M+CH3COO]- 295.00875 156.3
[M+Na-2H]- 256.96957 151.8
[M]+ 235.99435 159.4
[M]- 235.99545 159.4
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