CID 17039675

2,6-dichloro-8-methylquinoline-3-carboxaldehyde

Structural Information

Molecular Formula
C11H7Cl2NO
SMILES
CC1=CC(=CC2=CC(=C(N=C12)Cl)C=O)Cl
InChI
InChI=1S/C11H7Cl2NO/c1-6-2-9(12)4-7-3-8(5-15)11(13)14-10(6)7/h2-5H,1H3
InChIKey
LQGCPWAESLYAKC-UHFFFAOYSA-N
Compound name
2,6-dichloro-8-methylquinoline-3-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

238.99046 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.99774 145.4
[M+Na]+ 261.97968 163.1
[M+NH4]+ 257.02428 155.3
[M+K]+ 277.95362 153.9
[M-H]- 237.98318 148.4
[M+Na-2H]- 259.96513 153.4
[M]+ 238.98991 149.6
[M]- 238.99101 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

patents stripe