CID 13301743

1-(2-chloroquinolin-3-yl)ethan-1-ol

Structural Information

Molecular Formula
C11H10ClNO
SMILES
CC(C1=CC2=CC=CC=C2N=C1Cl)O
InChI
InChI=1S/C11H10ClNO/c1-7(14)9-6-8-4-2-3-5-10(8)13-11(9)12/h2-7,14H,1H3
InChIKey
BNZZXSYIUHVITJ-UHFFFAOYSA-N
Compound name
1-(2-chloroquinolin-3-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

207.04509 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.052366 140.7
[M+Na]+ 230.034308 150.7
[M-H]- 206.037814 142.8
[M+NH4]+ 225.078913 159.9
[M+K]+ 246.008248 145.7
[M+H-H2O]+ 190.042350 135.2
[M+HCOO]- 252.043291 156.4
[M+CH3COO]- 266.058941 183.8
[M+Na-2H]- 228.019756 147.7
[M]+ 207.04454142 142.4
[M]- 207.04563858 142.4
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