CID 762732

5,7-dimethyl-8-quinolinol

Structural Information

Molecular Formula
C11H11NO
SMILES
CC1=CC(=C(C2=C1C=CC=N2)O)C
InChI
InChI=1S/C11H11NO/c1-7-6-8(2)11(13)10-9(7)4-3-5-12-10/h3-6,13H,1-2H3
InChIKey
UKWMNFHGYXRSFQ-UHFFFAOYSA-N
Compound name
5,7-dimethylquinolin-8-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

199
Patents

173.08406 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.09134 134.9
[M+Na]+ 196.07328 145.4
[M-H]- 172.07678 137.7
[M+NH4]+ 191.11788 155.1
[M+K]+ 212.04722 141.7
[M+H-H2O]+ 156.08132 128.9
[M+HCOO]- 218.08226 156.2
[M+CH3COO]- 232.09791 180.2
[M+Na-2H]- 194.05873 142.8
[M]+ 173.08351 135.6
[M]- 173.08461 135.6
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