CID 24229208

2-chloro-3-iodopyridin-4-amine

Structural Information

Molecular Formula
C5H4ClIN2
SMILES
C1=CN=C(C(=C1N)I)Cl
InChI
InChI=1S/C5H4ClIN2/c6-5-4(7)3(8)1-2-9-5/h1-2H,(H2,8,9)
InChIKey
BYVMKCHHWASQFN-UHFFFAOYSA-N
Compound name
2-chloro-3-iodopyridin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

133
Patents

253.91077 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.918046 132.7
[M+Na]+ 276.899988 136.1
[M-H]- 252.903494 128.2
[M+NH4]+ 271.944593 148.5
[M+K]+ 292.873928 138.3
[M+H-H2O]+ 236.908030 124.0
[M+HCOO]- 298.908971 147.9
[M+CH3COO]- 312.924621 183.8
[M+Na-2H]- 274.885436 127.9
[M]+ 253.91022142 130.1
[M]- 253.91131858 130.1
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