CID 15239002

8-bromo-2-chloro-6-methylquinoline

Structural Information

Molecular Formula
C10H7BrClN
SMILES
CC1=CC2=C(C(=C1)Br)N=C(C=C2)Cl
InChI
InChI=1S/C10H7BrClN/c1-6-4-7-2-3-9(12)13-10(7)8(11)5-6/h2-5H,1H3
InChIKey
RWXMJDDUSCTUJI-UHFFFAOYSA-N
Compound name
8-bromo-2-chloro-6-methylquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

254.94504 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.95232 142.7
[M+Na]+ 277.93426 150.1
[M+NH4]+ 272.97886 149.5
[M+K]+ 293.90820 147.6
[M-H]- 253.93776 144.8
[M+Na-2H]- 275.91971 148.2
[M]+ 254.94449 143.7
[M]- 254.94559 143.7
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