CID 11253290

280116-78-1

Structural Information

Molecular Formula
C6H7IN2
SMILES
CNC1=NC=C(C=C1)I
InChI
InChI=1S/C6H7IN2/c1-8-6-3-2-5(7)4-9-6/h2-4H,1H3,(H,8,9)
InChIKey
JVPWDCQJEJGUST-UHFFFAOYSA-N
Compound name
5-iodo-N-methylpyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

36
Patents

233.9654 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.97268 132.1
[M+Na]+ 256.95462 137.4
[M+NH4]+ 251.99922 136.7
[M+K]+ 272.92856 134.2
[M-H]- 232.95812 128.5
[M+Na-2H]- 254.94007 127.5
[M]+ 233.96485 130.7
[M]- 233.96595 130.7
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