CID 59355267

6-chloro-2-iodo-4-methylpyridin-3-amine

Structural Information

Molecular Formula
C6H6ClIN2
SMILES
CC1=CC(=NC(=C1N)I)Cl
InChI
InChI=1S/C6H6ClIN2/c1-3-2-4(7)10-6(8)5(3)9/h2H,9H2,1H3
InChIKey
IOUXPZAGBJPWRP-UHFFFAOYSA-N
Compound name
6-chloro-2-iodo-4-methylpyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

125
Patents

267.92642 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.93370 136.8
[M+Na]+ 290.91564 140.7
[M-H]- 266.91914 132.5
[M+NH4]+ 285.96024 152.4
[M+K]+ 306.88958 142.7
[M+H-H2O]+ 250.92368 128.2
[M+HCOO]- 312.92462 151.7
[M+CH3COO]- 326.94027 187.8
[M+Na-2H]- 288.90109 130.9
[M]+ 267.92587 134.9
[M]- 267.92697 134.9
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