CID 237396

2,3-dimethylquinolin-4-ol

Structural Information

Molecular Formula
C11H11NO
SMILES
CC1=C(NC2=CC=CC=C2C1=O)C
InChI
InChI=1S/C11H11NO/c1-7-8(2)12-10-6-4-3-5-9(10)11(7)13/h3-6H,1-2H3,(H,12,13)
InChIKey
ZCHAUSWCWZYCNG-UHFFFAOYSA-N
Compound name
2,3-dimethyl-1H-quinolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

81
Patents

173.08406 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.09134 133.9
[M+Na]+ 196.07328 144.7
[M-H]- 172.07678 136.7
[M+NH4]+ 191.11788 154.1
[M+K]+ 212.04722 140.4
[M+H-H2O]+ 156.08132 128.0
[M+HCOO]- 218.08226 155.4
[M+CH3COO]- 232.09791 179.5
[M+Na-2H]- 194.05873 141.9
[M]+ 173.08351 134.0
[M]- 173.08461 134.0
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