CID 118021593

6-bromo-2,4-dichloro-3-methylquinoline

Structural Information

Molecular Formula
C10H6BrCl2N
SMILES
CC1=C(C2=C(C=CC(=C2)Br)N=C1Cl)Cl
InChI
InChI=1S/C10H6BrCl2N/c1-5-9(12)7-4-6(11)2-3-8(7)14-10(5)13/h2-4H,1H3
InChIKey
GDCMYYOPUXFEPC-UHFFFAOYSA-N
Compound name
6-bromo-2,4-dichloro-3-methylquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

288.90607 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.91335 149.4
[M+Na]+ 311.89529 157.6
[M+NH4]+ 306.93989 156.2
[M+K]+ 327.86923 154.5
[M-H]- 287.89879 151.4
[M+Na-2H]- 309.88074 154.5
[M]+ 288.90552 150.8
[M]- 288.90662 150.8
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