CID 113997

63680-58-0

Structural Information

Molecular Formula
C11H11ClN2
SMILES
C1=CC=C2C(=C1)C=CC(=N2)NCCCl
InChI
InChI=1S/C11H11ClN2/c12-7-8-13-11-6-5-9-3-1-2-4-10(9)14-11/h1-6H,7-8H2,(H,13,14)
InChIKey
XTNNMRPNACPWRB-UHFFFAOYSA-N
Compound name
N-(2-chloroethyl)quinolin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.06108 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.06836 141.7
[M+Na]+ 229.05030 157.1
[M+NH4]+ 224.09490 152.0
[M+K]+ 245.02424 147.9
[M-H]- 205.05380 145.8
[M+Na-2H]- 227.03575 150.7
[M]+ 206.06053 145.5
[M]- 206.06163 145.5
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

No patent data available for this compound.