CID 2763151

2-amino-3-iodopyridine

Structural Information

Molecular Formula

SMILES

C1=CC(=C(N=C1)N)I

InChI

InChI=1S/C5H5IN2/c6-4-2-1-3-8-5(4)7/h1-3H,(H2,7,8)

InChIKey

UUDNBWSHTUFGDQ-UHFFFAOYSA-N

Compound name

3-iodopyridin-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 580
Patents: 219.94975 Da
Monoisotopic Mass: 1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	220.957026	129.2
[M+Na]+	242.938968	131.0
[M-H]-	218.942474	124.5
[M+NH4]+	237.983573	145.2
[M+K]+	258.912908	135.1
[M+H-H2O]+	202.947010	119.5
[M+HCOO]-	264.947951	148.7
[M+CH3COO]-	278.963601	179.1
[M+Na-2H]-	240.924416	125.3
[M]+	219.94920142	124.4
[M]-	219.95029858	124.4

Literature stripe

literature stripe

Patent stripe

patents stripe