CID 58751475

5-chloro-3-(propan-2-yl)pyridin-2-amine

Structural Information

Molecular Formula
C8H11ClN2
SMILES
CC(C)C1=C(N=CC(=C1)Cl)N
InChI
InChI=1S/C8H11ClN2/c1-5(2)7-3-6(9)4-11-8(7)10/h3-5H,1-2H3,(H2,10,11)
InChIKey
LUDLKTOMAGJVRK-UHFFFAOYSA-N
Compound name
5-chloro-3-propan-2-ylpyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

170.06108 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.06836 134.4
[M+Na]+ 193.05030 143.8
[M-H]- 169.05380 136.6
[M+NH4]+ 188.09490 154.3
[M+K]+ 209.02424 140.1
[M+H-H2O]+ 153.05834 129.0
[M+HCOO]- 215.05928 152.8
[M+CH3COO]- 229.07493 182.0
[M+Na-2H]- 191.03575 139.3
[M]+ 170.06053 134.7
[M]- 170.06163 134.7
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