CID 594394

2-methylquinolin-3-ol

Structural Information

Molecular Formula
C10H9NO
SMILES
CC1=NC2=CC=CC=C2C=C1O
InChI
InChI=1S/C10H9NO/c1-7-10(12)6-8-4-2-3-5-9(8)11-7/h2-6,12H,1H3
InChIKey
OMQWBTOTNRMKAK-UHFFFAOYSA-N
Compound name
2-methylquinolin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

190
Patents

159.06842 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.07570 130.8
[M+Na]+ 182.05764 146.2
[M+NH4]+ 177.10224 140.5
[M+K]+ 198.03158 138.7
[M-H]- 158.06114 133.7
[M+Na-2H]- 180.04309 139.0
[M]+ 159.06787 133.9
[M]- 159.06897 133.9
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