CID 234275

4-chloro-2,6-dimethylquinoline

Structural Information

Molecular Formula
C11H10ClN
SMILES
CC1=CC2=C(C=C(N=C2C=C1)C)Cl
InChI
InChI=1S/C11H10ClN/c1-7-3-4-11-9(5-7)10(12)6-8(2)13-11/h3-6H,1-2H3
InChIKey
USUAZNLPQSKHJH-UHFFFAOYSA-N
Compound name
4-chloro-2,6-dimethylquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

17
Patents

191.05017 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.05745 137.1
[M+Na]+ 214.03939 154.5
[M+NH4]+ 209.08399 147.9
[M+K]+ 230.01333 145.3
[M-H]- 190.04289 141.1
[M+Na-2H]- 212.02484 146.0
[M]+ 191.04962 141.3
[M]- 191.05072 141.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe