CID 69011413

1-(7-chloroquinolin-2-yl)methanamine dihydrochloride

Structural Information

Molecular Formula
C10H9ClN2
SMILES
C1=CC(=CC2=C1C=CC(=N2)CN)Cl
InChI
InChI=1S/C10H9ClN2/c11-8-3-1-7-2-4-9(6-12)13-10(7)5-8/h1-5H,6,12H2
InChIKey
OUSCMBUQYHHWQZ-UHFFFAOYSA-N
Compound name
(7-chloroquinolin-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

192.04543 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.052706 137.7
[M+Na]+ 215.034648 148.1
[M-H]- 191.038154 140.7
[M+NH4]+ 210.079253 157.8
[M+K]+ 231.008588 142.7
[M+H-H2O]+ 175.042690 131.8
[M+HCOO]- 237.043631 156.4
[M+CH3COO]- 251.059281 151.2
[M+Na-2H]- 213.020096 146.2
[M]+ 192.04488142 138.4
[M]- 192.04597858 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