CID 130048265

3-iodopyrazolo[1,5-a]pyridin-5-amine

Structural Information

Molecular Formula
C7H6IN3
SMILES
C1=CN2C(=C(C=N2)I)C=C1N
InChI
InChI=1S/C7H6IN3/c8-6-4-10-11-2-1-5(9)3-7(6)11/h1-4H,9H2
InChIKey
FVMPDQVHTYVIBR-UHFFFAOYSA-N
Compound name
3-iodopyrazolo[1,5-a]pyridin-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.96063 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.967906 132.2
[M+Na]+ 281.949848 136.6
[M-H]- 257.953354 127.8
[M+NH4]+ 276.994453 148.6
[M+K]+ 297.923788 139.2
[M+H-H2O]+ 241.957890 122.0
[M+HCOO]- 303.958831 152.1
[M+CH3COO]- 317.974481 142.6
[M+Na-2H]- 279.935296 129.0
[M]+ 258.96008142 130.1
[M]- 258.96117858 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

No patent data available for this compound.