CID 85122

2-methylquinoline-4-carboxamide

Structural Information

Molecular Formula
C11H10N2O
SMILES
CC1=NC2=CC=CC=C2C(=C1)C(=O)N
InChI
InChI=1S/C11H10N2O/c1-7-6-9(11(12)14)8-4-2-3-5-10(8)13-7/h2-6H,1H3,(H2,12,14)
InChIKey
GPTOAZYKFYMYMW-UHFFFAOYSA-N
Compound name
2-methylquinoline-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

54
Patents

186.07932 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.08660 138.4
[M+Na]+ 209.06854 152.3
[M+NH4]+ 204.11314 147.3
[M+K]+ 225.04248 145.6
[M-H]- 185.07204 141.4
[M+Na-2H]- 207.05399 145.7
[M]+ 186.07877 141.2
[M]- 186.07987 141.2
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