CID 63232762

6-bromo-3-(propan-2-yl)quinolin-2-amine

Structural Information

Molecular Formula
C12H13BrN2
SMILES
CC(C)C1=C(N=C2C=CC(=CC2=C1)Br)N
InChI
InChI=1S/C12H13BrN2/c1-7(2)10-6-8-5-9(13)3-4-11(8)15-12(10)14/h3-7H,1-2H3,(H2,14,15)
InChIKey
UBXFYPCFXCADEQ-UHFFFAOYSA-N
Compound name
6-bromo-3-propan-2-ylquinolin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

264.0262 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.03348 149.5
[M+Na]+ 287.01542 154.0
[M+NH4]+ 282.06002 155.0
[M+K]+ 302.98936 153.2
[M-H]- 263.01892 151.4
[M+Na-2H]- 285.00087 153.3
[M]+ 264.02565 149.6
[M]- 264.02675 149.6
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.