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

53
Patents

235.9949 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.002176 141.2
[M+Na]+ 258.984118 153.4
[M-H]- 234.987624 147.3
[M+NH4]+ 254.028723 162.3
[M+K]+ 274.958058 141.6
[M+H-H2O]+ 218.992160 140.5
[M+HCOO]- 280.993101 162.5
[M+CH3COO]- 295.008751 156.3
[M+Na-2H]- 256.969566 151.8
[M]+ 235.99435142 159.4
[M]- 235.99544858 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