CID 3021730

7-chloro-5-methylquinolin-8-ol

Structural Information

Molecular Formula
C10H8ClNO
SMILES
CC1=CC(=C(C2=C1C=CC=N2)O)Cl
InChI
InChI=1S/C10H8ClNO/c1-6-5-8(11)10(13)9-7(6)3-2-4-12-9/h2-5,13H,1H3
InChIKey
ZIOISVUUZNUJNX-UHFFFAOYSA-N
Compound name
7-chloro-5-methylquinolin-8-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

193.02943 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.036706 136.0
[M+Na]+ 216.018648 147.7
[M-H]- 192.022154 138.7
[M+NH4]+ 211.063253 156.3
[M+K]+ 231.992588 142.5
[M+H-H2O]+ 176.026690 130.9
[M+HCOO]- 238.027631 153.0
[M+CH3COO]- 252.043281 150.0
[M+Na-2H]- 214.004096 144.0
[M]+ 193.02888142 138.4
[M]- 193.02997858 138.4
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