CID 593855

2-[(quinolin-2-yl)amino]ethan-1-ol

Structural Information

Molecular Formula
C11H12N2O
SMILES
C1=CC=C2C(=C1)C=CC(=N2)NCCO
InChI
InChI=1S/C11H12N2O/c14-8-7-12-11-6-5-9-3-1-2-4-10(9)13-11/h1-6,14H,7-8H2,(H,12,13)
InChIKey
MFOKDWUAYVSYHN-UHFFFAOYSA-N
Compound name
2-(quinolin-2-ylamino)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

18
Patents

188.09496 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.102236 138.4
[M+Na]+ 211.084178 146.0
[M-H]- 187.087684 140.2
[M+NH4]+ 206.128783 156.9
[M+K]+ 227.058118 142.2
[M+H-H2O]+ 171.092220 131.4
[M+HCOO]- 233.093161 160.7
[M+CH3COO]- 247.108811 182.8
[M+Na-2H]- 209.069626 148.2
[M]+ 188.09441142 137.6
[M]- 188.09550858 137.6
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