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

20
Patents

207.04509 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.05237 140.7
[M+Na]+ 230.03431 150.7
[M-H]- 206.03781 142.8
[M+NH4]+ 225.07891 159.9
[M+K]+ 246.00825 145.7
[M+H-H2O]+ 190.04235 135.2
[M+HCOO]- 252.04329 156.4
[M+CH3COO]- 266.05894 183.8
[M+Na-2H]- 228.01976 147.7
[M]+ 207.04454 142.4
[M]- 207.04564 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